Chemical Properties of 6,7-Epoxy himachalene (CAS 57819-73-5)

InChI

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

InChI Key

FDCRKPAGAMPEAD-UHFFFAOYSA-N

Formula

C15H24O

SMILES

CC1=CC2C(C)(C)CCCC3(C)OC23CC1

Molecular Weight¹

220.35

CAS

57819-73-5

Other Names

• Himachalen oxide («beta»)
• (+)-«beta»-Himachalene oxide

• 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	0.3591		Relay (1.0) Calculated Property
ΔfG°	131.40	kJ/mol	Joback Calculated Property
ΔfH°gas	-219.30	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	13.70	kJ/mol	Joback Calculated Property
ΔvapH°	64.84	kJ/mol	Relay (1.0) Calculated Property
IE	8.24	eV	Relay (1.0) Calculated Property
log10WS	-4.36		Relay (1.0) Calculated Property
logPoct/wat	4.080		Crippen Calculated Property
McVol	191.200	ml/mol	McGowan Calculated Property
Pc	2313.61	kPa	Joback Calculated Property
Inp	[1610.00; 1619.00]
Inp	1619.00		NIST
Inp	1610.00		NIST
I	[2004.00; 2045.00]
I	2004.00		NIST
I	2045.00		NIST
Tboil	531.15	K	Relay (1.0) Calculated Property
Tc	771.51	K	Relay (1.0) Calculated Property
Tfus	329.09	K	Relay (1.0) Calculated Property
Vc	0.692	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[537.54; 659.36]	J/mol×K	[602.77; 842.98]
Cp,gas	537.54	J/mol×K	602.77	Joback Calculated Property
Cp,gas	559.70	J/mol×K	642.81	Joback Calculated Property
Cp,gas	580.49	J/mol×K	682.84	Joback Calculated Property
Cp,gas	600.39	J/mol×K	722.88	Joback Calculated Property
Cp,gas	619.85	J/mol×K	762.91	Joback Calculated Property
Cp,gas	639.36	J/mol×K	802.95	Joback Calculated Property
Cp,gas	659.36	J/mol×K	842.98	Joback Calculated Property

Similar Compounds

Find more compounds similar to 6,7-Epoxy himachalene.

Sources

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

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