Chemical Properties of Anthracene, 9-dodecyltetradecahydro- (CAS 55401-75-7)

InChI

InChI=1S/C26H48/c1-2-3-4-5-6-7-8-9-10-11-20-26-24-18-14-12-16-22(24)21-23-17-13-15-19-25(23)26/h22-26H,2-21H2,1H3

InChI Key

QQGXTQQJKOBQFA-UHFFFAOYSA-N

Formula

C26H48

SMILES

CCCCCCCCCCCCC1C2CCCCC2CC2CCCCC21

Molecular Weight¹

360.66

CAS

55401-75-7

Other Names

• 9-n-Dodecyl(tetradecahydroanthracene)
• 9-Dodecyltetradecahydroanthracene
• 9-Dodecyltetrahydroanthracene

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.7560		Relay (1.0) Calculated Property
ΔfG°	274.37	kJ/mol	Joback Calculated Property
ΔfH°gas	-451.19	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	49.14	kJ/mol	Joback Calculated Property
ΔvapH°	114.15	kJ/mol	Relay (1.0) Calculated Property
IE	9.46	eV	Relay (1.0) Calculated Property
log10WS	-9.59		Relay (1.0) Calculated Property
logPoct/wat	8.930		Crippen Calculated Property
McVol	344.620	ml/mol	McGowan Calculated Property
Pc	938.07	kPa	Joback Calculated Property
Inp	[468.00; 468.00]
Inp	468.00		NIST
Inp	468.00		NIST
Tboil	677.90	K	Relay (1.0) Calculated Property
Tc	898.36	K	Relay (1.0) Calculated Property
Tfus	332.78	K	Relay (1.0) Calculated Property
Vc	1.276	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1203.39; 1337.35]	J/mol×K	[826.51; 1026.96]
Cp,gas	1203.39	J/mol×K	826.51	Joback Calculated Property
Cp,gas	1229.34	J/mol×K	859.92	Joback Calculated Property
Cp,gas	1253.73	J/mol×K	893.33	Joback Calculated Property
Cp,gas	1276.64	J/mol×K	926.73	Joback Calculated Property
Cp,gas	1298.15	J/mol×K	960.14	Joback Calculated Property
Cp,gas	1318.36	J/mol×K	993.55	Joback Calculated Property
Cp,gas	1337.35	J/mol×K	1026.96	Joback Calculated Property
η	[0.0003380; 0.0030069]	Pa×s	[410.52; 826.51]
η	0.0030069	Pa×s	410.52	Joback Calculated Property
η	0.0016056	Pa×s	479.85	Joback Calculated Property
η	0.0010045	Pa×s	549.18	Joback Calculated Property
η	0.0006982	Pa×s	618.51	Joback Calculated Property
η	0.0005222	Pa×s	687.85	Joback Calculated Property
η	0.0004119	Pa×s	757.18	Joback Calculated Property
η	0.0003380	Pa×s	826.51	Joback Calculated Property
ΔvapH	102.70	kJ/mol	518.50	NIST

Similar Compounds

Find more compounds similar to Anthracene, 9-dodecyltetradecahydro-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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