Chemical Properties of Guaia-3,10(14)-dien-11-ol (CAS 176435-26-0)

InChI

InChI=1S/C15H24O/c1-10-5-7-12(15(3,4)16)9-14-11(2)6-8-13(10)14/h6,12-14,16H,1,5,7-9H2,2-4H3/t12-,13+,14-/m1/s1

InChI Key

KOMASUWOXAIAJL-HZSPNIEDSA-N

Formula

C15H24O

SMILES

C=C1CCC(C(C)(C)O)CC2C(C)=CCC12

Molecular Weight¹

220.35

CAS

176435-26-0

• 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).
• 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

Property	Value	Unit	Source
ΔfG°	80.24	kJ/mol	Joback Calculated Property
ΔfH°gas	-282.74	kJ/mol	Joback Calculated Property
ΔfusH°	19.89	kJ/mol	Joback Calculated Property
ΔvapH°	65.69	kJ/mol	Joback Calculated Property
log10WS	-4.25		Crippen Calculated Property
logPoct/wat	3.696		Crippen Calculated Property
McVol	197.760	ml/mol	McGowan Calculated Property
Pc	2104.20	kPa	Joback Calculated Property
Inp	[1672.00; 1680.00]
Inp	1680.00		NIST
Inp	1678.00		NIST
Inp	1679.00		NIST
Inp	1672.00		NIST
Tboil	660.74	K	Joback Calculated Property
Tc	867.43	K	Joback Calculated Property
Tfus	366.57	K	Joback Calculated Property
Vc	0.735	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[577.77; 675.30]	J/mol×K	[660.74; 867.43]
Cp,gas	577.77	J/mol×K	660.74	Joback Calculated Property
Cp,gas	596.79	J/mol×K	695.19	Joback Calculated Property
Cp,gas	614.62	J/mol×K	729.64	Joback Calculated Property
Cp,gas	631.32	J/mol×K	764.08	Joback Calculated Property
Cp,gas	646.96	J/mol×K	798.53	Joback Calculated Property
Cp,gas	661.60	J/mol×K	832.98	Joback Calculated Property
Cp,gas	675.30	J/mol×K	867.43	Joback Calculated Property
η	[0.0001124; 0.0040813]	Pa×s	[366.57; 660.74]
η	0.0040813	Pa×s	366.57	Joback Calculated Property
η	0.0015755	Pa×s	415.60	Joback Calculated Property
η	0.0007435	Pa×s	464.63	Joback Calculated Property
η	0.0004050	Pa×s	513.65	Joback Calculated Property
η	0.0002452	Pa×s	562.68	Joback Calculated Property
η	0.0001609	Pa×s	611.71	Joback Calculated Property
η	0.0001124	Pa×s	660.74	Joback Calculated Property

Similar Compounds

Find more compounds similar to Guaia-3,10(14)-dien-11-ol.

Sources

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

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