Chemical Properties of «beta»-Longipinene

InChI

InChI=1S/C14H22/c1-9-6-7-11-10-5-4-8-14(2,3)13(11)12(9)10/h10-13H,1,4-8H2,2-3H3

InChI Key

VJRRUPHSDRBMPP-UHFFFAOYSA-N

Formula

C14H22

SMILES

C=C1CCC2C3CCCC(C)(C)C2C13

Molecular Weight¹

190.32

• ω : Acentric Factor.
• 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).
• 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.
• 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
ω	0.3213		Relay (1.0) Calculated Property
ΔfG°	257.22	kJ/mol	Joback Calculated Property
ΔfH°gas	-42.58	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	16.91	kJ/mol	Joback Calculated Property
ΔvapH°	56.90	kJ/mol	Relay (1.0) Calculated Property
IE	8.69	eV	Relay (1.0) Calculated Property
log10WS	-5.63		Relay (1.0) Calculated Property
logPoct/wat	4.025		Crippen Calculated Property
McVol	171.240	ml/mol	McGowan Calculated Property
Pc	2216.62	kPa	Joback Calculated Property
Inp	[1380.00; 1432.50]
Inp	1418.00		NIST
Inp	Outlier 1432.50		NIST
Inp	1398.00		NIST
Inp	1398.00		NIST
Inp	1390.00		NIST
Inp	1398.00		NIST
Inp	1401.00		NIST
Inp	Outlier 1430.00		NIST
Inp	1412.00		NIST
Inp	1405.00		NIST
Inp	1398.00		NIST
Inp	1398.00		NIST
Inp	1394.00		NIST
Inp	1396.00		NIST
Inp	1400.00		NIST
Inp	1410.00		NIST
Inp	1402.00		NIST
Inp	1398.00		NIST
Inp	1399.00		NIST
Inp	1403.20		NIST
Inp	1380.00		NIST
Inp	1386.00		NIST
Inp	1403.00		NIST
Inp	1405.00		NIST
Inp	1403.00		NIST
Inp	1400.00		NIST
Inp	1400.00		NIST
Inp	1381.00		NIST
Inp	1403.00		NIST
Inp	1398.00		NIST
Inp	1403.00		NIST
Inp	1401.00		NIST
Inp	1401.00		NIST
Inp	Outlier 1432.00		NIST
Inp	Outlier 1432.00		NIST
Inp	1398.00		NIST
Inp	1403.00		NIST
Inp	Outlier 1432.00		NIST
Inp	1418.00		NIST
I	[1599.00; 1626.00]
I	1599.00		NIST
I	1614.00		NIST
I	1626.00		NIST
I	1612.00		NIST
I	1614.00		NIST
I	1600.00		NIST
I	1612.00		NIST
I	1599.00		NIST
Tboil	519.85	K	Relay (1.0) Calculated Property
Tc	764.79	K	Relay (1.0) Calculated Property
Tfus	332.82	K	Relay (1.0) Calculated Property
Vc	0.595	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[450.99; 569.43]	J/mol×K	[538.54; 757.73]
Cp,gas	450.99	J/mol×K	538.54	Joback Calculated Property
Cp,gas	474.07	J/mol×K	575.07	Joback Calculated Property
Cp,gas	495.58	J/mol×K	611.60	Joback Calculated Property
Cp,gas	515.69	J/mol×K	648.14	Joback Calculated Property
Cp,gas	534.59	J/mol×K	684.67	Joback Calculated Property
Cp,gas	552.44	J/mol×K	721.20	Joback Calculated Property
Cp,gas	569.43	J/mol×K	757.73	Joback Calculated Property

Similar Compounds

Find more compounds similar to «beta»-Longipinene.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.