Basic information
- CAS
123293-66-3- Standard SMILES
CCOC(=O)/C=C/c1ccsc1- InChIKey
JVKOMXUTXGBJFC-ONEGZZNKSA-N- Molecular formula
- C9H10O2S
- Average molar mass
- 182.24 g/mol
- Monoisotopic mass
- 182.04015056
Names & identifiers
- Preferred name
- Ethyl (2E)-3-(3-thienyl)-2-propenoate
- IUPAC
- ethyl (E)-3-thiophen-3-ylprop-2-enoate
Names & synonyms
123293-66-3Ethyl (2E)-3-(3-thienyl)-2-propenoateRefChem:341688(E)-Ethyl 3-(thiophen-3-yl)acrylate50266-60-92-Propenoic acid, 3-(3-thienyl)-, ethyl esterETHYL (2E)-3-(THIOPHEN-3-YL)PROP-2-ENOATEethyl 3-(thiophen-3-yl)acrylateEthyl (E)-3-thiophen-3-ylprop-2-enoateEthyl-3-(thiophen-3-yl)acrylateMFCD07778410ethyl (E)-3-(3-thienyl)prop-2-enoate
Show more names
Ethyl 3-(3-Thienyl)acrylateSCHEMBL1126665JVKOMXUTXGBJFC-ONEGZZNKSA-NDTXSID101286735(E)-Ethyl3-(thiophen-3-yl)acrylateAKOS006230060ethyl (e)-3-(3-thienyl)-2-propenoateBS-28585
Database identifiers
- CAS
123293-66-3- PubChem CID
- 10986919
- DTXSID
DTXSID101286735- Nikkaji
- J672.954A、J672.960F
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 177
Related reactions
2 records
Compound notes
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