Chemical Properties of 2-Thiophenebutanoic acid, methyl ester (CAS 20828-66-4)

2-Thiophenebutanoic acid, methyl ester

PDF Excel Molecule Calculator
InChI
InChI=1S/C9H12O2S/c1-11-9(10)6-2-4-8-5-3-7-12-8/h3,5,7H,2,4,6H2,1H3
InChI Key
FUTXOYOSYBCRBT-UHFFFAOYSA-N
Formula
C9H12O2S
SMILES
COC(=O)CCCc1cccs1
Molecular Weight1
184.25
CAS
20828-66-4
Other Names
  • Methyl 4-(2-thienyl)butanoate
  • 4-(2-Thienyl)butanoic acid methyl ester
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
IE 8.40 ± 0.30 eV NIST
log10WS -2.15 Crippen Calculated Property
logPoct/wat 2.244 Crippen Calculated Property
McVol 142.000 ml/mol McGowan Calculated Property

Similar Compounds

4-(2-Thienyl)butyric acid. Thiophene, 2-butyl-. Thiophene, 2-pentyl-. Thiophene, 2-octyl-. 2-n-Hexadecylthiophene. Thiophene, 2-decyl-. Thiophene, 2-heptyl-. 2-Tetradecylthiophene. Thiophene, 2-hexyl-. 2-(4,8,12-Trimethyltridecyl) thiophene. Thiophene, 2-propyl-. 2-Thiopheneethanol, alpha-methyl-. Thiophene, 2-(3-methylbutyl)-5-propyl-. 5-Butyl-3-carboxaldehyde-thiophene. Thiophene, 2-butyl-5-ethenyl.

Find more compounds similar to 2-Thiophenebutanoic acid, 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.