Chemical Properties of (+)-(1S,3aR,7S,7aR)-2,3,3a,4,5,6,7,7a-Octahydro-7,7a-dimethyl-1-(2-methylpropanolyl)-1H-indene

InChI

InChI=1S/C15H28O/c1-10(2)14(16)13-9-8-12-7-5-6-11(3)15(12,13)4/h10-14,16H,5-9H2,1-4H3/t11-,12+,13+,14?,15-/m1/s1

InChI Key

OLSZYGCUKSYWHW-YKYMWBLQSA-N

Formula

C15H28O

SMILES

CC(C)C(O)C1CCC2CCCC(C)C21C

Molecular Weight¹

224.38

• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[618.09; 728.62]	J/mol×K	[651.09; 851.50]
Cp,gas	618.09	J/mol×K	651.09	Joback Calculated Property
Cp,gas	638.74	J/mol×K	684.49	Joback Calculated Property
Cp,gas	658.35	J/mol×K	717.89	Joback Calculated Property
Cp,gas	677.02	J/mol×K	751.29	Joback Calculated Property
Cp,gas	694.88	J/mol×K	784.70	Joback Calculated Property
Cp,gas	712.04	J/mol×K	818.10	Joback Calculated Property
Cp,gas	728.62	J/mol×K	851.50	Joback Calculated Property

Similar Compounds

Find more compounds similar to (+)-(1S,3aR,7S,7aR)-2,3,3a,4,5,6,7,7a-Octahydro-7,7a-dimethyl-1-(2-methylpropanolyl)-1H-indene.

Sources

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

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