Chemical Properties of «beta»-Cedrene epoxide

InChI

InChI=1S/C15H24O/c1-10-4-5-11-13(2,3)12-8-14(10,11)6-7-15(12)9-16-15/h10-12H,4-9H2,1-3H3/t10-,11+,12?,14+,15?/m0/s1

InChI Key

BWDPPCMUUFETAC-MJAQFUTBSA-N

Formula

C15H24O

SMILES

CC1CCC2C(C)(C)C3CC12CCC31CO1

Molecular Weight¹

220.35

• 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	0.3786		Relay (... Calculated Property
ΔfG°	188.31	kJ/mol	Joback Calculated Property
ΔfH°gas	-145.73	kJ/mol	Relay (... Calculated Property
ΔfusH°	16.27	kJ/mol	Joback Calculated Property
ΔvapH°	70.89	kJ/mol	Relay (... Calculated Property
IE	8.74	eV	Relay (... Calculated Property
log10WS	-4.71		Relay (... Calculated Property
logPoct/wat	3.628		Crippen Calculated Property
McVol	184.640	ml/mol	McGowan Calculated Property
Pc	2372.59	kPa	Joback Calculated Property
Inp	[1596.00; 1623.00]
Inp	1623.00		NIST
Inp	1596.00		NIST
Inp	1596.00		NIST
Inp	1623.00		NIST
Inp	1623.00		NIST
Inp	1623.00		NIST
Inp	1622.00		NIST
Inp	1623.00		NIST
I	[2046.00; 2046.00]
I	2046.00		NIST
I	2046.00		NIST
Tboil	544.00	K	Relay (... Calculated Property
Tc	810.59	K	Relay (... Calculated Property
Tfus	366.21	K	Relay (... Calculated Property
Vc	0.703	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[541.84; 665.85]	J/mol×K	[592.16; 829.78]
Cp,gas	541.84	J/mol×K	592.16	Joback Calculated Property
Cp,gas	564.86	J/mol×K	631.76	Joback Calculated Property
Cp,gas	586.26	J/mol×K	671.37	Joback Calculated Property
Cp,gas	606.55	J/mol×K	710.97	Joback Calculated Property
Cp,gas	626.24	J/mol×K	750.57	Joback Calculated Property
Cp,gas	645.84	J/mol×K	790.17	Joback Calculated Property
Cp,gas	665.85	J/mol×K	829.78	Joback Calculated Property

Similar Compounds

Find more compounds similar to «beta»-Cedrene epoxide.

Sources

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

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