Basic information
- CAS
1089327-21-8- Standard SMILES
CCOc1ccccc1NC(=O)/C=C\C(=O)O- InChIKey
BLCLJDWSZXZERU-FPLPWBNLSA-N- Molecular formula
- C12H13NO4
- Average molar mass
- 235.24 g/mol
- Monoisotopic mass
- 235.0844579
Names & identifiers
- Preferred name
- (2Z)-4-[(2-ethoxyphenyl)amino]-4-oxobut-2-enoic acid
- IUPAC
- (Z)-4-(2-ethoxyanilino)-4-oxobut-2-enoic acid
- English name
- 2-butenoic acid, 4-[(2-ethoxyphenyl)amino]-4-oxo-, (2Z)-
- Molecular formula
- C12H13NO4
- Molecular weight
- 235.24
Names & synonyms
1089327-21-8(2Z)-4-[(2-ethoxyphenyl)amino]-4-oxobut-2-enoic acid(Z)-4-((2-ethoxyphenyl)amino)-4-oxobut-2-enoic acid(2Z)-3-[(2-ethoxyphenyl)carbamoyl]prop-2-enoic acid(Z)-4-(2-ethoxyanilino)-4-oxobut-2-enoic acidMFCD001347402-butenoic acid, 4-[(2-ethoxyphenyl)amino]-4-oxo-, (2Z)-SCHEMBL7814618ALBB-013691AKOS002671904LS-04300CS-0363223
Show more names
(Z)-4-[(2-ethoxyphenyl)amino]-4-oxobut-2-enoic acid(Z)-4-[(2-ethoxyphenyl)amino]-4-oxo-but-2-enoic acid(Z)-4-[(2-ethoxyphenyl)amino]-4-keto-but-2-enoic acid
H30460(Z)-4-(2-ethoxyanilino)-4-oxo-but-2-enoic acid(Z)-4-((2-ethoxyphenyl)amino)-4-oxobut-2-enoicacidF1018-0782
Database identifiers
- CAS
1089327-21-8- PubChem CID
- 1581599
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 301
Chemistry & industry
Suppliers1 total
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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