Chemical Properties of Acenaphthene (CAS 83-32-9)

InChI

InChI=1S/C12H10/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-6H,7-8H2

InChI Key

CWRYPZZKDGJXCA-UHFFFAOYSA-N

Formula

C12H10

SMILES

c1cc2c3c(cccc3c1)CC2

Molecular Weight¹

154.21

CAS

83-32-9

Other Names

• 1,2-DIHYDRO-ACENAPHTHYLENE
• 1,2-dihydroacenaphthylene
• 1,8-Ethylenenaphthalene
• Acenaphthylene, 1,2-dihydro-
• Naphthyleneethylene
• Peri-Ethylenenaphthalene
• acenaphtene

• PAff : Proton affinity (kJ/mol).
• BasG : Gas basicity (kJ/mol).
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,solid : Solid phase heat capacity (J/mol×K).
• C_sat : Molar heat capacity at saturation pressure (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_subH° : Enthalpy of sublimation at standard conditions (kJ/mol).
• Δ_subH : Enthalpy of sublimation at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• P_sub : Sublimation pressure (kPa).
• P_vap : Vapor pressure (kPa).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• S°_{solid,1 bar} : Solid phase molar entropy at standard conditions (J/mol×K).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
PAff	[849.80; 851.70]	kJ/mol
PAff	851.70	kJ/mol	NIST
PAff	849.80	kJ/mol	NIST
BasG	[821.00; 821.70]	kJ/mol
BasG	821.00	kJ/mol	NIST
BasG	821.70	kJ/mol	NIST
ΔcH°solid	-6222.00 ± 3.00	kJ/mol	NIST
ΔfH°gas	[156.00; 156.80]	kJ/mol
ΔfH°gas	156.80 ± 3.10	kJ/mol	NIST
ΔfH°gas	156.00 ± 4.00	kJ/mol	NIST
ΔfH°solid	[70.00; 72.00]	kJ/mol
ΔfH°solid	72.00 ± 3.10	kJ/mol	NIST
ΔfH°solid	70.00 ± 3.00	kJ/mol	NIST
ΔfusH°	16.28	kJ/mol	Joback Calculated Property
ΔsubH°	[83.40; 86.00]	kJ/mol
ΔsubH°	84.80 ± 0.40	kJ/mol	NIST
ΔsubH°	84.60	kJ/mol	NIST
ΔsubH°	83.40 ± 1.00	kJ/mol	NIST
ΔsubH°	86.00 ± 1.00	kJ/mol	NIST
ΔsubH°	86.00	kJ/mol	NIST
ΔsubH°	83.40 ± 1.00	kJ/mol	NIST
ΔvapH°	[66.20; 70.50]	kJ/mol
ΔvapH°	68.00	kJ/mol	NIST
ΔvapH°	70.50 ± 1.10	kJ/mol	NIST
ΔvapH°	66.20	kJ/mol	NIST
ΔvapH°	66.20	kJ/mol	NIST
ΔvapH°	66.50 ± 1.30	kJ/mol	NIST
IE	[7.66; 7.82]	eV
IE	7.75 ± 0.05	eV	NIST
IE	7.68 ± 0.05	eV	NIST
IE	7.73 ± 0.01	eV	NIST
IE	7.66	eV	NIST
IE	7.76 ± 0.03	eV	NIST
IE	7.82 ± 0.04	eV	NIST
log10WS	-4.58		Aq. Solubility Prediction
logPoct/wat	2.938		Crippen Calculated Property
McVol	125.860	ml/mol	McGowan Calculated Property
Pc	3517.91	kPa	Joback Calculated Property
Inp	[231.65; 1526.00]
Inp	1472.00		NIST
Inp	1472.00		NIST
Inp	1475.00		NIST
Inp	1486.00		NIST
Inp	1463.90		NIST
Inp	1475.00		NIST
Inp	1481.40		NIST
Inp	1480.50		NIST
Inp	1468.00		NIST
Inp	1481.40		NIST
Inp	1488.60		NIST
Inp	1468.00		NIST
Inp	1481.40		NIST
Inp	1488.60		NIST
Inp	1481.40		NIST
Inp	1480.50		NIST
Inp	1445.50		NIST
Inp	1445.30		NIST
Inp	1493.00		NIST
Inp	1456.00		NIST
Inp	1481.00		NIST
Inp	1461.00		NIST
Inp	1458.00		NIST
Inp	1455.06		NIST
Inp	1488.20		NIST
Inp	1503.00		NIST
Inp	1439.00		NIST
Inp	1472.00		NIST
Inp	1450.00		NIST
Inp	1464.00		NIST
Inp	1455.00		NIST
Inp	1458.00		NIST
Inp	1466.00		NIST
Inp	1472.00		NIST
Inp	1518.00		NIST
Inp	1520.00		NIST
Inp	1523.00		NIST
Inp	1523.00		NIST
Inp	1523.00		NIST
Inp	1523.00		NIST
Inp	1523.00		NIST
Inp	1523.00		NIST
Inp	1523.00		NIST
Inp	1523.00		NIST
Inp	1525.00		NIST
Inp	1526.00		NIST
Inp	1496.00		NIST
Inp	1503.00		NIST
Inp	1492.00		NIST
Inp	1494.00		NIST
Inp	1483.00		NIST
Inp	1483.00		NIST
Inp	1485.00		NIST
Inp	1485.00		NIST
Inp	1485.00		NIST
Inp	1486.00		NIST
Inp	1491.00		NIST
Inp	1491.00		NIST
Inp	1460.00		NIST
Inp	1437.00		NIST
Inp	1474.00		NIST
Inp	1457.00		NIST
Inp	1476.00		NIST
Inp	1447.00		NIST
Inp	1446.00		NIST
Inp	1463.00		NIST
Inp	1494.00		NIST
Inp	1494.00		NIST
Inp	1522.00		NIST
Inp	254.40		NIST
Inp	242.90		NIST
Inp	243.10		NIST
Inp	251.29		NIST
Inp	253.30		NIST
Inp	254.07		NIST
Inp	243.16		NIST
Inp	243.16		NIST
Inp	254.87		NIST
Inp	254.36		NIST
Inp	254.04		NIST
Inp	254.10		NIST
Inp	254.21		NIST
Inp	254.30		NIST
Inp	254.33		NIST
Inp	254.60		NIST
Inp	254.83		NIST
Inp	254.89		NIST
Inp	254.91		NIST
Inp	253.90		NIST
Inp	254.30		NIST
Inp	253.54		NIST
Inp	253.91		NIST
Inp	254.80		NIST
Inp	253.71		NIST
Inp	253.67		NIST
Inp	254.98		NIST
Inp	231.65		NIST
Inp	253.14		NIST
Inp	251.29		NIST
Inp	255.00		NIST
Inp	253.56		NIST
Inp	253.56		NIST
Inp	253.67		NIST
Inp	254.50		NIST
Inp	251.99		NIST
Inp	245.85		NIST
Inp	245.90		NIST
Inp	251.30		NIST
Inp	253.30		NIST
Inp	253.50		NIST
Inp	253.30		NIST
Inp	245.85		NIST
Inp	245.90		NIST
Inp	257.17		NIST
Inp	255.60		NIST
Inp	253.50		NIST
Inp	247.80		NIST
Inp	1464.00		NIST
Inp	1481.40		NIST
Inp	1468.00		NIST
Inp	1445.50		NIST
Inp	1461.00		NIST
Inp	1455.06		NIST
Inp	1450.00		NIST
Inp	254.40		NIST
Inp	254.07		NIST
Inp	254.04		NIST
Inp	254.60		NIST
Inp	254.30		NIST
Inp	253.67		NIST
Inp	1457.00		NIST
Inp	1494.00		NIST
Inp	1472.00		NIST
Inp	1523.00		NIST
Inp	1492.00		NIST
Inp	1485.00		NIST
Inp	1460.00		NIST
I	[2092.00; 2133.00]
I	2132.00		NIST
I	2108.00		NIST
I	2133.00		NIST
I	2092.00		NIST
I	2103.00		NIST
S°solid,1 bar	188.87	J/mol×K	NIST
Tboil	[502.65; 552.20]	K
Tboil	552.20	K	NIST
Tboil	552.00	K	NIST
Tboil	502.65 ± 1.00	K	NIST
Tc	820.00	K	Critical point measurement of some polycyclic aromatic hydrocarbons
Tfus	[363.00; 370.00]	K
Tfus	367.55	K	Aq. Solubility Prediction
Tfus	364.02 ± 0.20	K	NIST
Tfus	369.00	K	NIST
Tfus	366.50 ± 0.20	K	NIST
Tfus	363.10 ± 1.00	K	NIST
Tfus	366.40 ± 0.20	K	NIST
Tfus	367.20 ± 3.00	K	NIST
Tfus	370.00 ± 1.50	K	NIST
Tfus	367.65 ± 1.00	K	NIST
Tfus	363.00 ± 1.00	K	NIST
Tfus	368.35 ± 0.50	K	NIST
Tfus	367.80 ± 0.20	K	NIST
Tfus	366.00 ± 0.20	K	NIST
Tfus	367.25 ± 0.50	K	NIST
Ttriple	[366.55; 366.56]	K
Ttriple	366.56 ± 0.02	K	NIST
Ttriple	366.55 ± 0.02	K	NIST
Ttriple	366.56 ± 0.02	K	NIST
Vc	0.493	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[280.07; 349.45]	J/mol×K	[536.92; 778.15]
Cp,gas	280.07	J/mol×K	536.92	Joback Calculated Property
Cp,gas	294.31	J/mol×K	577.12	Joback Calculated Property
Cp,gas	307.29	J/mol×K	617.33	Joback Calculated Property
Cp,gas	319.17	J/mol×K	657.53	Joback Calculated Property
Cp,gas	330.06	J/mol×K	697.74	Joback Calculated Property
Cp,gas	340.11	J/mol×K	737.94	Joback Calculated Property
Cp,gas	349.45	J/mol×K	778.15	Joback Calculated Property
Cp,solid	[185.80; 210.50]	J/mol×K	[298.00; 298.15]
Cp,solid	185.80	J/mol×K	298.00	NIST
Cp,solid	210.50	J/mol×K	298.10	NIST
Cp,solid	190.37	J/mol×K	298.15	NIST
Csat	[268.90; 287.80]	J/mol×K	[380.00; 420.00]
Csat	268.90	J/mol×K	380.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Csat	273.60	J/mol×K	390.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Csat	278.30	J/mol×K	400.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Csat	283.10	J/mol×K	410.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Csat	287.80	J/mol×K	420.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
η	[0.0007313; 0.0014227]	Pa×s	[334.86; 536.92]
η	0.0014227	Pa×s	334.86	Joback Calculated Property
η	0.0012104	Pa×s	368.54	Joback Calculated Property
η	0.0010580	Pa×s	402.21	Joback Calculated Property
η	0.0009443	Pa×s	435.89	Joback Calculated Property
η	0.0008566	Pa×s	469.57	Joback Calculated Property
η	0.0007873	Pa×s	503.24	Joback Calculated Property
η	0.0007313	Pa×s	536.92	Joback Calculated Property
ΔfusH	[20.23; 25.10]	kJ/mol	[366.40; 367.80]
ΔfusH	20.23	kJ/mol	366.40	NIST
ΔfusH	21.46	kJ/mol	366.56	NIST
ΔfusH	21.46	kJ/mol	366.56	NIST
ΔfusH	21.46	kJ/mol	366.60	NIST
ΔfusH	21.46	kJ/mol	366.60	NIST
ΔfusH	21.00	kJ/mol	367.00	NIST
ΔfusH	25.10	kJ/mol	367.80	NIST
ΔsubH	[77.00; 86.80]	kJ/mol	[283.00; 383.00]
ΔsubH	84.70 ± 2.70	kJ/mol	283.00	NIST
ΔsubH	81.60	kJ/mol	283.00	NIST
ΔsubH	82.10 ± 0.40	kJ/mol	300.50	NIST
ΔsubH	86.80 ± 0.90	kJ/mol	303.00	NIST
ΔsubH	86.20 ± 0.80	kJ/mol	315.00	NIST
ΔsubH	77.00	kJ/mol	317.50	NIST
ΔsubH	82.40	kJ/mol	366.00	NIST
ΔsubH	82.13 ± 0.42	kJ/mol	368.00	NIST
ΔsubH	83.20	kJ/mol	383.00	NIST
ΔvapH	[54.00; 67.98]	kJ/mol	[298.00; 490.50]
ΔvapH	67.98	kJ/mol	298.00	Enthalpies of Vaporization and Vapor Pressures of Some Deuterated Hydrocarbons. Liquid-Vapor Pressure Isotope Effects
ΔvapH	61.10	kJ/mol	366.00	NIST
ΔvapH	60.60	kJ/mol	378.00	NIST
ΔvapH	60.30	kJ/mol	390.50	NIST
ΔvapH	61.30	kJ/mol	395.00	NIST
ΔvapH	63.90	kJ/mol	398.00	NIST
ΔvapH	54.00	kJ/mol	460.00	NIST
ΔvapH	54.30	kJ/mol	487.00	NIST
ΔvapH	55.40	kJ/mol	490.50	NIST
Psub	[2.90e-04; 1.80e-03]	kPa	[297.60; 315.60]
Psub	2.90e-04	kPa	297.60	Vapor Pressures and Enthalpies of Sublimation of Ten Polycyclic Aromatic Hydrocarbons Determined via the Knudsen Effusion Method
Psub	3.62e-04	kPa	299.70	Vapor Pressures and Enthalpies of Sublimation of Ten Polycyclic Aromatic Hydrocarbons Determined via the Knudsen Effusion Method
Psub	4.13e-04	kPa	300.50	Vapor Pressures and Enthalpies of Sublimation of Ten Polycyclic Aromatic Hydrocarbons Determined via the Knudsen Effusion Method
Psub	4.40e-04	kPa	301.60	Vapor Pressures and Enthalpies of Sublimation of Ten Polycyclic Aromatic Hydrocarbons Determined via the Knudsen Effusion Method
Psub	5.08e-04	kPa	302.80	Vapor Pressures and Enthalpies of Sublimation of Ten Polycyclic Aromatic Hydrocarbons Determined via the Knudsen Effusion Method
Psub	6.93e-04	kPa	306.10	Vapor Pressures and Enthalpies of Sublimation of Ten Polycyclic Aromatic Hydrocarbons Determined via the Knudsen Effusion Method
Psub	1.12e-03	kPa	310.70	Vapor Pressures and Enthalpies of Sublimation of Ten Polycyclic Aromatic Hydrocarbons Determined via the Knudsen Effusion Method
Psub	1.80e-03	kPa	315.60	Vapor Pressures and Enthalpies of Sublimation of Ten Polycyclic Aromatic Hydrocarbons Determined via the Knudsen Effusion Method
ΔfusS	[55.22; 68.20]	J/mol×K	[366.40; 367.80]
ΔfusS	55.22	J/mol×K	366.40	NIST
ΔfusS	58.55	J/mol×K	366.56	NIST
ΔfusS	58.55	J/mol×K	366.56	NIST
ΔfusS	68.20	J/mol×K	367.80	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.68]	kPa	[405.49; 502.35]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			2.24317e+01
Coefficient B			-7.30879e+03
Coefficient C			-7.54360e+01
Temperature range, min.			405.49
Temperature range, max.			502.35
Pvap	1.33	kPa	405.49	Calculated Property
Pvap	2.68	kPa	416.25	Calculated Property
Pvap	5.17	kPa	427.01	Calculated Property
Pvap	9.59	kPa	437.78	Calculated Property
Pvap	17.16	kPa	448.54	Calculated Property
Pvap	29.72	kPa	459.30	Calculated Property
Pvap	49.95	kPa	470.06	Calculated Property
Pvap	81.66	kPa	480.83	Calculated Property
Pvap	130.17	kPa	491.59	Calculated Property
Pvap	202.68	kPa	502.35	Calculated Property
Pvap	[0.20; 3117.44]	kPa	[366.15; 803.15]	KDB Vapor Pressure Data
Equation			ln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A			6.77558e+01
Coefficient B			-9.75784e+03
Coefficient C			-7.27940e+00
Coefficient D			1.74725e-06
Temperature range, min.			366.15
Temperature range, max.			803.15
Pvap	0.20	kPa	366.15	Calculated Property
Pvap	1.91	kPa	414.71	Calculated Property
Pvap	10.85	kPa	463.26	Calculated Property
Pvap	42.08	kPa	511.82	Calculated Property
Pvap	124.32	kPa	560.37	Calculated Property
Pvap	300.56	kPa	608.93	Calculated Property
Pvap	625.18	kPa	657.48	Calculated Property
Pvap	1159.47	kPa	706.04	Calculated Property
Pvap	1968.02	kPa	754.59	Calculated Property
Pvap	3117.44	kPa	803.15	Calculated Property

Similar Compounds

Find more compounds similar to Acenaphthene.

Mixtures

• Acenaphthene + Carbazole
• Anthracene + Acenaphthene
• 9H-Fluoren-9-one + Acenaphthene
• Ethanol + Acenaphthene
• Ethanol + 9H-Fluoren-9-one + Acenaphthene
• Acenaphthene + Water
• Acenaphthene + Acetone
• Acenaphthene + 1-Propanol, 2-methyl-
• Benzene + Acenaphthene
• Acenaphthene + Benzene, 1,3-dimethyl-
• 1-Propanol + Acenaphthene

Sources

• KDB Vapor Pressure Data
• Cheméo Relay (1.0)
• Crippen Method
• Solid-liquid phase equilibrium of 9-fluorenone and several polynuclear aromatic hydrocarbons
• Solid-liquid equilibrium of some polycyclic aromatic hydrocarbons in wash oil
• Critical point measurement of some polycyclic aromatic hydrocarbons
• Modified solution calorimetry approach for determination of vaporization and sublimation enthalpies of branched-chain aliphatic and alkyl aromatic compounds at T = 298.15 K
• New aspects of relationship between the enthalpies of fusion of aromatic compounds at the melting temperatures and the enthalpies of solution in benzene at 298.15 K. Part I
• Solubility of Acenaphthene, Anthracene, and Pyrene in Water At 50 C to 300 C
• Ionic Liquids/Water Distribution Ratios of Some Polycyclic Aromatic Hydrocarbons
• Solid Liquid Phase Equilibrium and Solubility of Dibenzo[b,d]furan and 9H-Fluoren-9-one in Organic Solvents
• Determination of Henry's Law Constant Using Diffusion in Air and Water Boundary Layers
• Vapor Pressures and Enthalpies of Sublimation of Ten Polycyclic Aromatic Hydrocarbons Determined via the Knudsen Effusion Method
• Enthalpies of Vaporization and Vapor Pressures of Some Deuterated Hydrocarbons. Liquid-Vapor Pressure Isotope Effects
• Solubility of Acenaphthene in Different Solvents from (283.00 to 323.00) K
• Joback Method
• KDB
• Aqueous Solubility Prediction Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure
• Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD

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