Chemical Properties of Pentanoic acid, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, endo- (CAS 7549-41-9)

InChI

InChI=1S/C15H26O2/c1-5-6-7-13(16)17-12-10-11-8-9-15(12,4)14(11,2)3/h11-12H,5-10H2,1-4H3

InChI Key

ILUAVCBOWYHFAI-UHFFFAOYSA-N

Formula

C15H26O2

SMILES

CCCCC(=O)OC1CC2CCC1(C)C2(C)C

Molecular Weight¹

238.37

CAS

7549-41-9

Other Names

• Bornyl ester of n-pentanoic acid
• Valeric acid, 2-bornyl ester, endo-
• Bornyl valerate
• «alpha»-Terpinyl ester of n-pentanoic acid
• Bornyl pentanoate
• endo-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl valerate

• 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).
• 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	[593.16; 702.24]	J/mol×K	[627.78; 833.26]
Cp,gas	593.16	J/mol×K	627.78	Joback Calculated Property
Cp,gas	613.03	J/mol×K	662.03	Joback Calculated Property
Cp,gas	631.96	J/mol×K	696.27	Joback Calculated Property
Cp,gas	650.15	J/mol×K	730.52	Joback Calculated Property
Cp,gas	667.80	J/mol×K	764.77	Joback Calculated Property
Cp,gas	685.10	J/mol×K	799.01	Joback Calculated Property
Cp,gas	702.24	J/mol×K	833.26	Joback Calculated Property

Similar Compounds

Find more compounds similar to Pentanoic acid, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, endo-.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.