Chemical Properties of 1-Cycloheptene-1-carboxylic acid, 6-oxo-, methyl ester (CAS 42205-56-1)

1-Cycloheptene-1-carboxylic acid, 6-oxo-, methyl ester

PDF Excel Molecule Calculator
InChI
InChI=1S/C9H12O3/c1-12-9(11)7-4-2-3-5-8(10)6-7/h4H,2-3,5-6H2,1H3
InChI Key
OYDFMULXKLIRIL-UHFFFAOYSA-N
Formula
C9H12O3
SMILES
COC(=O)C1=CCCCC(=O)C1
Molecular Weight1
168.19
CAS
42205-56-1
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δf -291.22 kJ/mol Joback Calculated Property
Δfgas -496.78 kJ/mol Joback Calculated Property
Δfus 10.86 kJ/mol Joback Calculated Property
Δvap 50.89 kJ/mol Joback Calculated Property
log10WS -1.48 Crippen Calculated Property
logPoct/wat 1.229 Crippen Calculated Property
McVol 131.520 ml/mol McGowan Calculated Property
Pc 3392.03 kPa Joback Calculated Property
Tboil 582.06 K Joback Calculated Property
Tc 816.73 K Joback Calculated Property
Tfus 352.95 K Joback Calculated Property
Vc 0.482 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [318.77; 398.75] J/mol×K [582.06; 816.73] Show Hide
Cp,gas 318.77 J/mol×K 582.06 Joback Calculated Property
Cp,gas 334.33 J/mol×K 621.17 Joback Calculated Property
Cp,gas 349.05 J/mol×K 660.28 Joback Calculated Property
Cp,gas 362.88 J/mol×K 699.40 Joback Calculated Property
Cp,gas 375.80 J/mol×K 738.51 Joback Calculated Property
Cp,gas 387.76 J/mol×K 777.62 Joback Calculated Property
Cp,gas 398.75 J/mol×K 816.73 Joback Calculated Property

Similar Compounds

3-(Methoxycarbonyl)-2-cycloheptenone. Methyl 1-cyclohexene-1-carboxylate. 3-(Methoxycarbonyl)-3-cyclooctenone. 1-Cyclohexene-1-carboxylic acid, 4-(1,5-dimethyl-3-oxohexyl)-, methyl ester, [R-(R*,R*)]-. 1-Cyclohexene-1-carboxylic acid, 4-(1,5-dimethyl-3-oxo-4-hexenyl)-, methyl ester, [R-(R*,R*)]-. 1-Cyclopentene-1-carboxylic acid, methyl ester. Methyl 4-(prop-1-en-2-yl)cyclohex-1-enecarboxylate. Methylmyrtenate. 1-Cyclohexene-1-carboxylic acid. 2-Octenoic acid, 2-butyl. Methyl (E)-trans-«alpha»-bergamota-2,10-dien-12-oate. Dimethyl (Z)-2-n-hexyl-3-methylbutendioate. Methyldavanate. Myrtenyl angelate. (2E,6E)-Methyl-3,7,11-trimethyl-10-oxododecadienoate.

Find more compounds similar to 1-Cycloheptene-1-carboxylic acid, 6-oxo-, methyl ester.

Sources

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.