Chemical Properties of Podocarp-7-en-3-one, 13«beta»-methyl-13-vinyl- (CAS 7715-48-2)

InChI

InChI=1S/C20H30O/c1-6-19(4)11-9-15-14(13-19)7-8-16-18(2,3)17(21)10-12-20(15,16)5/h6-7,15-16H,1,8-13H2,2-5H3

InChI Key

YAXFLCDQLAZOPS-UHFFFAOYSA-N

Formula

C20H30O

SMILES

C=CC1(C)CCC2C(=CCC3C(C)(C)C(=O)CCC23C)C1

Molecular Weight¹

286.45

CAS

7715-48-2

Other Names

• Pimara-7,15-dien-3-one
• Isopimara-7,15-dien-3-one

• 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.
• 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°	192.96	kJ/mol	Joback Calculated Property
ΔfH°gas	-229.45	kJ/mol	Joback Calculated Property
ΔfusH°	13.77	kJ/mol	Joback Calculated Property
ΔvapH°	61.17	kJ/mol	Joback Calculated Property
log10WS	-5.66		Crippen Calculated Property
logPoct/wat	5.321		Crippen Calculated Property
McVol	253.050	ml/mol	McGowan Calculated Property
Pc	1657.84	kPa	Joback Calculated Property
Inp	[2227.00; 2279.00]
Inp	2227.00		NIST
Inp	2279.00		NIST
Tboil	758.59	K	Joback Calculated Property
Tc	1008.37	K	Joback Calculated Property
Tfus	494.34	K	Joback Calculated Property
Vc	0.953	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[807.74; 977.24]	J/mol×K	[758.59; 1008.37]
Cp,gas	807.74	J/mol×K	758.59	Joback Calculated Property
Cp,gas	834.81	J/mol×K	800.22	Joback Calculated Property
Cp,gas	861.72	J/mol×K	841.85	Joback Calculated Property
Cp,gas	888.95	J/mol×K	883.48	Joback Calculated Property
Cp,gas	916.96	J/mol×K	925.11	Joback Calculated Property
Cp,gas	946.23	J/mol×K	966.74	Joback Calculated Property
Cp,gas	977.24	J/mol×K	1008.37	Joback Calculated Property

Similar Compounds

Find more compounds similar to Podocarp-7-en-3-one, 13«beta»-methyl-13-vinyl-.

Sources

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

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