Chemical Properties of Bicyclo[5.4.0]undecane (trans) (CAS 21394-30-9)

InChI

InChI=1S/C11H20/c1-2-6-10-8-4-5-9-11(10)7-3-1/h10-11H,1-9H2/t10-,11-/m1/s1

InChI Key

GBCQLGDTLMHVHU-GHMZBOCLSA-N

Formula

C11H20

SMILES

C1CCC2CCCCC2CC1

Molecular Weight¹

152.28

CAS

21394-30-9

Other Names

• trans-Decahydro-1H-benzo[a]cycloheptene
• trans-Bicyclo[5.4.0]undecane

• 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).
• 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[167.49; 555.20]	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			-1.33200e+02
Coefficient B			1.30260e+00
Coefficient C			-7.83000e-04
Coefficient D			1.68800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	167.49	J/mol×K	273.00	Calculated Property
Cp,gas	237.11	J/mol×K	353.78	Calculated Property
Cp,gas	298.84	J/mol×K	434.56	Calculated Property
Cp,gas	353.23	J/mol×K	515.33	Calculated Property
Cp,gas	400.81	J/mol×K	596.11	Calculated Property
Cp,gas	442.11	J/mol×K	676.89	Calculated Property
Cp,gas	477.67	J/mol×K	757.67	Calculated Property
Cp,gas	508.01	J/mol×K	838.44	Calculated Property
Cp,gas	533.68	J/mol×K	919.22	Calculated Property
Cp,gas	555.20	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0074291; 0.0003064]	Pa×s	[232.01; 499.45]	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			-1.08563e+01
Coefficient B			1.38137e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			232.01
Temperature range, max.			499.45
η	0.0074291	Pa×s	232.01	Calculated Property
η	0.0037789	Pa×s	261.73	Calculated Property
η	0.0022062	Pa×s	291.44	Calculated Property
η	0.0014230	Pa×s	321.16	Calculated Property
η	0.0009885	Pa×s	350.87	Calculated Property
η	0.0007269	Pa×s	380.59	Calculated Property
η	0.0005589	Pa×s	410.30	Calculated Property
η	0.0004452	Pa×s	440.02	Calculated Property
η	0.0003650	Pa×s	469.73	Calculated Property
η	0.0003064	Pa×s	499.45	Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[5.4.0]undecane (trans).

Sources

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

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