Chemical Properties of 1,4-Methano-1H-indene, octahydro-1,7a-dimethyl-4-(1-methylethenyl)-, [1S-(1«alpha»,3a«beta»,4«alpha»,7a«beta»)]- (CAS 87064-18-4)

InChI

InChI=1S/C15H24/c1-11(2)15-8-5-7-14(4)12(15)6-9-13(14,3)10-15/h12H,1,5-10H2,2-4H3

InChI Key

MTBNHGFRLZSOTC-UHFFFAOYSA-N

Formula

C15H24

SMILES

C=C(C)C12CCCC3(C)C1CCC3(C)C2

Molecular Weight¹

204.35

CAS

87064-18-4

Other Names

• Alloisolongifolene

• 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.
• 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	0.3395		Relay (... Calculated Property
ΔfG°	300.68	kJ/mol	Joback Calculated Property
ΔfH°gas	-9.68	kJ/mol	Relay (... Calculated Property
ΔfusH°	6.50	kJ/mol	Joback Calculated Property
ΔvapH°	63.01	kJ/mol	Relay (... Calculated Property
IE	8.63	eV	Relay (... Calculated Property
log10WS	-5.12		Relay (... Calculated Property
logPoct/wat	4.559		Crippen Calculated Property
McVol	185.330	ml/mol	McGowan Calculated Property
Pc	2280.59	kPa	Joback Calculated Property
Inp	[1409.00; 1409.00]
Inp	1409.00		NIST
Inp	1409.00		NIST
Tboil	531.09	K	Relay (... Calculated Property
Tc	774.06	K	Relay (... Calculated Property
Tfus	365.85	K	Relay (... Calculated Property
Vc	0.670	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[498.32; 616.56]	J/mol×K	[559.70; 792.42]
Cp,gas	498.32	J/mol×K	559.70	Joback Calculated Property
Cp,gas	521.02	J/mol×K	598.49	Joback Calculated Property
Cp,gas	541.91	J/mol×K	637.27	Joback Calculated Property
Cp,gas	561.45	J/mol×K	676.06	Joback Calculated Property
Cp,gas	580.10	J/mol×K	714.85	Joback Calculated Property
Cp,gas	598.31	J/mol×K	753.63	Joback Calculated Property
Cp,gas	616.56	J/mol×K	792.42	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,4-Methano-1H-indene, octahydro-1,7a-dimethyl-4-(1-methylethenyl)-, [1S-(1«alpha»,3a«beta»,4«alpha»,7a«beta»)]-.

Sources

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

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