Chemical Properties of 1H-Indene, octahydro-2,2,4,4,7,7-hexamethyl-, trans- (CAS 54832-83-6)

InChI

InChI=1S/C15H28/c1-13(2)9-11-12(10-13)15(5,6)8-7-14(11,3)4/h11-12H,7-10H2,1-6H3/t11-,12-/m0/s1

InChI Key

RKCBUJRCTQZATH-RYUDHWBXSA-N

Formula

C15H28

SMILES

CC1(C)CC2C(C1)C(C)(C)CCC2(C)C

Molecular Weight¹

208.38

CAS

54832-83-6

• 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	0.3671		Relay (... Calculated Property
ΔfG°	121.02	kJ/mol	Joback Calculated Property
ΔfH°gas	-230.48	kJ/mol	Relay (... Calculated Property
ΔfusH°	8.89	kJ/mol	Joback Calculated Property
ΔvapH°	62.89	kJ/mol	Relay (... Calculated Property
IE	8.95	eV	Relay (... Calculated Property
log10WS	-6.27		Relay (... Calculated Property
logPoct/wat	4.885		Crippen Calculated Property
McVol	200.490	ml/mol	McGowan Calculated Property
Pc	1911.91	kPa	Joback Calculated Property
Inp	[1427.10; 1427.10]
Inp	1427.10		NIST
Inp	1427.10		NIST
Inp	1427.10		NIST
Tboil	508.44	K	Relay (... Calculated Property
Tc	724.20	K	Relay (... Calculated Property
Tfus	326.62	K	Relay (... Calculated Property
Vc	0.735	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[535.95; 667.85]	J/mol×K	[555.60; 778.34]
Cp,gas	535.95	J/mol×K	555.60	Joback Calculated Property
Cp,gas	560.92	J/mol×K	592.72	Joback Calculated Property
Cp,gas	584.25	J/mol×K	629.85	Joback Calculated Property
Cp,gas	606.28	J/mol×K	666.97	Joback Calculated Property
Cp,gas	627.33	J/mol×K	704.09	Joback Calculated Property
Cp,gas	647.74	J/mol×K	741.21	Joback Calculated Property
Cp,gas	667.85	J/mol×K	778.34	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1H-Indene, octahydro-2,2,4,4,7,7-hexamethyl-, trans-.

Sources

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

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