Ethyl 3-(p-acetamidoanilino)crotonate
Basic information
- CAS
63304-45-0- Standard SMILES
CCOC(=O)/C=C(\C)Nc1ccc(NC(C)=O)cc1- InChIKey
JBJTUFMRQIGTQN-UHFFFAOYSA-N- Molecular formula
- C14H18N2O3
- Average molar mass
- 262.3 g/mol
- Monoisotopic mass
- 262.13174244
Names & identifiers
- Preferred name
- Ethyl 3-(p-acetamidoanilino)crotonate
- IUPAC
- ethyl (E)-3-(4-acetamidoanilino)but-2-enoate
- English name
- Ethyl 3-(p-acetamidoanilino)crotonate
- Molecular formula
- C14H18N2O3
- Molecular weight
- 262.3
Names & synonyms
Ethyl 3-(p-acetamidoanilino)crotonateNSC20872563304-45-0SR-01000315069NSC25202ethyl (E)-3-(4-acetamidoanilino)but-2-enoateSCHEMBL10862592JBJTUFMRQIGTQN-MDZDMXLPSA-NNSC-25202AKOS000618658NSC-208725ST50239052
Show more names
2-Butenoic acid, 3-[[4-(acetylamino)phenyl]amino]-, ethyl ester
ethyl 3-[4-(acetylamino)anilino]-2-butenoateAH-034/32472042SR-01000315069-1SR-01000315069-2Ethyl (2E)-3-[4-(acetylamino)anilino]-2-butenoateEthyl (2E)-3-[4-(acetylamino)anilino]-2-butenoate #ethyl (2E)-3-{[4-(acetylamino)phenyl]amino}but-2-enoate2-Butenoic acid, 3-[[4-(acetylamino)phenyl]amino]-, ethyl ester, (2E)-
Database identifiers
- CAS
63304-45-0- PubChem CID
- 759385
- Nikkaji
- J1.427.380H、J2.620.184E
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 345
Chemistry & industry
Upstream & downstream products
Downstream products
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Compound notes
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