Chemical Properties of Sarcosine, N-(2-thienylcarbonyl)-, isobutyl ester

Sarcosine, N-(2-thienylcarbonyl)-, isobutyl ester

InChI
InChI=1S/C12H17NO3S/c1-9(2)8-16-11(14)7-13(3)12(15)10-5-4-6-17-10/h4-6,9H,7-8H2,1-3H3
InChI Key
LNIXBQAZRSFNTG-UHFFFAOYSA-N
Formula
C12H17NO3S
SMILES
CC(C)COC(=O)CN(C)C(=O)c1cccs1
Molecular Weight1
255.33
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
ΔvapH° 79.32 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 2.019 Crippen Calculated Property
McVol 195.820 ml/mol McGowan Calculated Property
Inp [1992.00; 1992.00]   Show Hide
Inp 1992.00 NIST
Inp 1992.00 NIST
Tboil 598.81 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Sarcosine, N-(2-thienylcarbonyl)-, propyl ester. Sarcosine, N-(2-thienylcarbonyl)-, butyl ester. Sarcosine, N-(2-thienylcarbonyl)-, pentyl ester. Sarcosine, N-(2-thienylcarbonyl)-, heptyl ester. Sarcosine, n-(2-thienylcarbonyl)-, hexyl ester. Sarcosine, n-(2-thienylcarbonyl)-, dodecyl ester. Sarcosine, N-(2-thienylcarbonyl)-, pentadecyl ester. Sarcosine, N-(2-thienylcarbonyl)-, undecyl ester. Sarcosine, N-(2-thienylcarbonyl)-, octyl ester. Sarcosine, N-(2-thienylcarbonyl)-, tetradecyl ester. Sarcosine, N-(2-thienylcarbonyl)-, decyl ester. Sarcosine, N-(2-thienylcarbonyl)-, nonyl ester. Sarcosine, N-(2-thienylcarbonyl)-, isohexyl ester. Sarcosine, N-(2-thienylcarbonyl)-, ethyl ester. L-Proline, N-(thiophen-2-carbonyl)-, isobutyl ester.

Find more compounds similar to Sarcosine, N-(2-thienylcarbonyl)-, isobutyl 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.
These property values are available through the Cheméo API. A free account gives you an access key.