Chemical Properties of 2,6,10-Dodecatrien-1-ol, 3,7,11-trimethyl-, (Z,Z)- (CAS 16106-95-9)

InChI

InChI=1S/C15H26O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,11,16H,5-6,8,10,12H2,1-4H3/b14-9-,15-11-

InChI Key

CRDAMVZIKSXKFV-FBXUGWQNSA-N

Formula

C15H26O

SMILES

CC(C)=CCCC(C)=CCCC(C)=CCO

Molecular Weight¹

222.37

CAS

16106-95-9

Other Names

• cis,cis-Farnesol
• (Z,Z)-Farnesol
• (2Z,6Z)-Farnesol
• Farnesol (Z,Z)

• 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°	153.61	kJ/mol	Joback Calculated Property
ΔfH°gas	-182.87	kJ/mol	Joback Calculated Property
ΔfusH°	35.37	kJ/mol	Joback Calculated Property
ΔvapH°	65.78	kJ/mol	Joback Calculated Property
log10WS	-4.93		Crippen Calculated Property
logPoct/wat	4.398		Crippen Calculated Property
McVol	215.180	ml/mol	McGowan Calculated Property
Pc	1743.37	kPa	Joback Calculated Property
Inp	[1664.00; 1728.00]
Inp	1720.70		NIST
Inp	1713.00		NIST
Inp	1713.00		NIST
Inp	1713.00		NIST
Inp	1708.00		NIST
Inp	1713.00		NIST
Inp	1722.00		NIST
Inp	1718.00		NIST
Inp	1713.00		NIST
Inp	1713.00		NIST
Inp	Outlier 1664.00		NIST
Inp	1718.00		NIST
Inp	1728.00		NIST
Inp	1693.00		NIST
Inp	1712.00		NIST
Inp	1702.00		NIST
Inp	1688.00		NIST
Inp	1682.00		NIST
Inp	1715.00		NIST
Inp	1723.00		NIST
Inp	1712.00		NIST
Inp	1683.00		NIST
Inp	1690.00		NIST
Inp	1714.00		NIST
Inp	1693.00		NIST
Inp	1693.00		NIST
Inp	1717.00		NIST
Inp	1716.00		NIST
Inp	1722.00		NIST
Inp	Outlier 1672.00		NIST
Inp	1697.00		NIST
Inp	1709.00		NIST
Inp	1713.00		NIST
Inp	1718.00		NIST
Inp	1692.00		NIST
Inp	1692.00		NIST
Inp	1708.00		NIST
Inp	1713.00		NIST
Inp	1716.00		NIST
Inp	1718.00		NIST
Inp	1728.00		NIST
Inp	1682.00		NIST
Inp	1690.00		NIST
I	[2275.00; 2335.00]
I	2275.00		NIST
I	Outlier 2335.00		NIST
I	2287.00		NIST
I	2287.00		NIST
I	2287.00		NIST
I	2287.00		NIST
Tboil	646.90	K	Joback Calculated Property
Tc	826.12	K	Joback Calculated Property
Tfus	262.51	K	Joback Calculated Property
Vc	0.838	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[573.45; 656.14]	J/mol×K	[646.90; 826.12]
Cp,gas	573.45	J/mol×K	646.90	Joback Calculated Property
Cp,gas	588.94	J/mol×K	676.77	Joback Calculated Property
Cp,gas	603.68	J/mol×K	706.64	Joback Calculated Property
Cp,gas	617.71	J/mol×K	736.51	Joback Calculated Property
Cp,gas	631.10	J/mol×K	766.38	Joback Calculated Property
Cp,gas	643.89	J/mol×K	796.25	Joback Calculated Property
Cp,gas	656.14	J/mol×K	826.12	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,6,10-Dodecatrien-1-ol, 3,7,11-trimethyl-, (Z,Z)-.

Sources

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

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.