Chemical Properties of Bicyclo[5.3.0]decane (cis) (CAS 16189-46-1)

InChI

InChI=1S/C10H18/c1-2-5-9-7-4-8-10(9)6-3-1/h9-10H,1-8H2/t9-,10+

InChI Key

ODJQFZXHKPCJMD-AOOOYVTPSA-N

Formula

C10H18

SMILES

C1CCC2CCCC2CC1

Molecular Weight¹

138.25

CAS

16189-46-1

Other Names

• Decahydroazulene, cis-
• cis-Bicyclo[5.3.0]decane
• cis-Perhydroazulene

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,liquid : Liquid phase 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).
• P_vap : Vapor 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	0.2635		Relay (1.0) Calculated Property
ΔfG°	106.42	kJ/mol	Joback Calculated Property
ΔfH°gas	-141.13	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	9.53	kJ/mol	Joback Calculated Property
ΔvapH°	53.60 ± 1.20	kJ/mol	NIST
IE	9.27	eV	Relay (1.0) Calculated Property
log10WS	-5.13		Relay (1.0) Calculated Property
logPoct/wat	3.367		Crippen Calculated Property
McVol	130.040	ml/mol	McGowan Calculated Property
Pc	3025.61	kPa	Joback Calculated Property
Inp	[1095.00; 1095.00]
Inp	1095.00		NIST
Inp	1095.00		NIST
Tboil	466.72	K	Relay (1.0) Calculated Property
Tc	696.22	K	Relay (1.0) Calculated Property
Tfus	235.70	K	Relay (1.0) Calculated Property
Vc	0.458	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,liquid	311.30	J/mol×K	377.00	NIST
ΔvapH	[46.90; 49.80]	kJ/mol	[337.50; 377.00]
ΔvapH	49.80	kJ/mol	337.50	NIST
ΔvapH	46.90 ± 0.80	kJ/mol	377.00	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[151.17; 501.83]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.27170e+02
Coefficient B			1.21720e+00
Coefficient C			-7.75000e-04
Coefficient D			1.86800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	151.17	J/mol×K	273.00	Calculated Property
Cp,gas	214.72	J/mol×K	353.78	Calculated Property
Cp,gas	270.75	J/mol×K	434.56	Calculated Property
Cp,gas	319.84	J/mol×K	515.33	Calculated Property
Cp,gas	362.59	J/mol×K	596.11	Calculated Property
Cp,gas	399.58	J/mol×K	676.89	Calculated Property
Cp,gas	431.41	J/mol×K	757.67	Calculated Property
Cp,gas	458.67	J/mol×K	838.44	Calculated Property
Cp,gas	481.95	J/mol×K	919.22	Calculated Property
Cp,gas	501.83	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0046703; 0.0003698]	Pa×s	[224.26; 476.77]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.01549e+01
Coefficient B			1.07384e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			224.26
Temperature range, max.			476.77
η	0.0046703	Pa×s	224.26	Calculated Property
η	0.0027422	Pa×s	252.32	Calculated Property
η	0.0017912	Pa×s	280.37	Calculated Property
η	0.0012642	Pa×s	308.43	Calculated Property
η	0.0009457	Pa×s	336.49	Calculated Property
η	0.0007397	Pa×s	364.55	Calculated Property
η	0.0005993	Pa×s	392.60	Calculated Property
η	0.0004994	Pa×s	420.66	Calculated Property
η	0.0004257	Pa×s	448.72	Calculated Property
η	0.0003698	Pa×s	476.77	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[341.11; 491.54]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.46796e+01
Coefficient B			-4.03704e+03
Coefficient C			-6.06090e+01
Temperature range, min.			341.11
Temperature range, max.			491.54
Pvap	1.33	kPa	341.11	Calculated Property
Pvap	2.99	kPa	357.82	Calculated Property
Pvap	6.17	kPa	374.54	Calculated Property
Pvap	11.82	kPa	391.25	Calculated Property
Pvap	21.27	kPa	407.97	Calculated Property
Pvap	36.27	kPa	424.68	Calculated Property
Pvap	59.02	kPa	441.40	Calculated Property
Pvap	92.17	kPa	458.11	Calculated Property
Pvap	138.85	kPa	474.83	Calculated Property
Pvap	202.64	kPa	491.54	Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[5.3.0]decane (cis).

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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