Chemical Properties of Bicyclo[3.3.3]undecane (CAS 29415-95-0)

InChI

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

InChI Key

NAVGAEZCCRCJQT-UHFFFAOYSA-N

Formula

C11H20

SMILES

C1CC2CCCC(C1)CCC2

Molecular Weight¹

152.28

CAS

29415-95-0

• 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).
• 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_fH°_solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (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).
• 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).
• Δ_subS : Entropy of sublimation at a given temperature (J/mol×K).
• 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
ΔcH°solid	-7034.00 ± 2.00	kJ/mol	NIST
ΔfG°	102.74	kJ/mol	Joback Calculated Property
ΔfH°gas	-89.00 ± 2.00	kJ/mol	NIST
ΔfH°solid	-152.50 ± 1.80	kJ/mol	NIST
ΔfusH°	10.02	kJ/mol	Joback Calculated Property
ΔsubH°	[63.50; 63.60]	kJ/mol
ΔsubH°	63.60 ± 0.84	kJ/mol	NIST
ΔsubH°	63.50	kJ/mol	NIST
ΔvapH°	40.77	kJ/mol	Joback Calculated Property
log10WS	-3.73		Crippen Calculated Property
logPoct/wat	3.757		Crippen Calculated Property
McVol	144.130	ml/mol	McGowan Calculated Property
Pc	2802.44	kPa	Joback Calculated Property
Tboil	485.91	K	Joback Calculated Property
Tc	713.20	K	Joback Calculated Property
Tfus	232.01	K	Joback Calculated Property
Vc	0.525	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[334.24; 458.77]	J/mol×K	[485.91; 713.20]
Cp,gas	334.24	J/mol×K	485.91	Joback Calculated Property
Cp,gas	358.53	J/mol×K	523.79	Joback Calculated Property
Cp,gas	381.33	J/mol×K	561.67	Joback Calculated Property
Cp,gas	402.70	J/mol×K	599.56	Joback Calculated Property
Cp,gas	422.69	J/mol×K	637.44	Joback Calculated Property
Cp,gas	441.37	J/mol×K	675.32	Joback Calculated Property
Cp,gas	458.77	J/mol×K	713.20	Joback Calculated Property
Cp,solid	213.20	J/mol×K	298.15	NIST
η	[0.0003310; 0.0074291]	Pa×s	[232.01; 485.91]
η	0.0074291	Pa×s	232.01	Joback Calculated Property
η	0.0029653	Pa×s	274.33	Joback Calculated Property
η	0.0015129	Pa×s	316.64	Joback Calculated Property
η	0.0009046	Pa×s	358.96	Joback Calculated Property
η	0.0006029	Pa×s	401.28	Joback Calculated Property
η	0.0004341	Pa×s	443.59	Joback Calculated Property
η	0.0003310	Pa×s	485.91	Joback Calculated Property
ΔsubH	6.36	kJ/mol	298.15	NIST
ΔsubS	21.33	J/mol×K	298.15	NIST

Similar Compounds

Find more compounds similar to Bicyclo[3.3.3]undecane.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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