Chemical Properties of (+)-4-Carene (CAS 29050-33-7)

InChI

InChI=1S/C10H16/c1-7-4-5-8-9(6-7)10(8,2)3/h4-5,7-9H,6H2,1-3H3

InChI Key

LGNSZMLHOYDATP-UHFFFAOYSA-N

Formula

C10H16

SMILES

CC1C=CC2C(C1)C2(C)C

Molecular Weight¹

136.23

CAS

29050-33-7

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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.
• I : 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
ΔfG°	151.77	kJ/mol	Joback Calculated Property
ΔfH°gas	-77.95	kJ/mol	Joback Calculated Property
ΔfusH°	12.89	kJ/mol	Joback Calculated Property
ΔvapH°	36.38	kJ/mol	Joback Calculated Property
log10WS	-2.68		Crippen Calculated Property
logPoct/wat	2.855		Crippen Calculated Property
McVol	125.740	ml/mol	McGowan Calculated Property
Pc	2835.36	kPa	Joback Calculated Property
Inp	[987.00; 1030.00]
Inp	1004.00		NIST
Inp	1030.00		NIST
Inp	1014.00		NIST
Inp	1022.00		NIST
Inp	1009.00		NIST
Inp	1008.00		NIST
Inp	998.00		NIST
Inp	1001.00		NIST
Inp	1017.00		NIST
Inp	996.00		NIST
Inp	1022.00		NIST
Inp	1002.50		NIST
Inp	1002.00		NIST
Inp	1001.00		NIST
Inp	1022.00		NIST
Inp	998.00		NIST
Inp	1018.00		NIST
Inp	998.00		NIST
Inp	987.00		NIST
Inp	1011.00		NIST
Inp	987.00		NIST
I	[1128.00; 1157.00]
I	1149.00		NIST
I	1149.00		NIST
I	1144.00		NIST
I	1128.00		NIST
I	1157.00		NIST
Tboil	436.01	K	Joback Calculated Property
Tc	643.39	K	Joback Calculated Property
Tfus	251.00	K	Joback Calculated Property
Vc	0.483	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[272.63; 368.57]	J/mol×K	[436.01; 643.39]
Cp,gas	272.63	J/mol×K	436.01	Joback Calculated Property
Cp,gas	291.69	J/mol×K	470.57	Joback Calculated Property
Cp,gas	309.35	J/mol×K	505.14	Joback Calculated Property
Cp,gas	325.74	J/mol×K	539.70	Joback Calculated Property
Cp,gas	340.98	J/mol×K	574.26	Joback Calculated Property
Cp,gas	355.22	J/mol×K	608.83	Joback Calculated Property
Cp,gas	368.57	J/mol×K	643.39	Joback Calculated Property

Similar Compounds

Find more compounds similar to (+)-4-Carene.

Sources

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

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