Basic information
- CAS
56395-51-8- Standard SMILES
CCOC(=O)/C=C(\Nc1cc([N+](=O)[O-])ccc1Cl)OCC- InChIKey
HQNNPPIMYIDPEH-XYOKQWHBSA-N- Molecular formula
- C13H15ClN2O5
- Average molar mass
- 314.72 g/mol
- Monoisotopic mass
- 314.0669493
Names & identifiers
- Preferred name
- 2-Propenoic acid, 3-[(2-chloro-5-nitrophenyl)amino]-3-ethoxy-, ethyl ester
- IUPAC
- ethyl (E)-3-(2-chloro-5-nitroanilino)-3-ethoxyprop-2-enoate
Names & synonyms
Ethyl 3-ethoxy-3-((2-chloro-5-nitrophenyl)amino)-2-propenoate2-Propenoic acid, 3-((2-chloro-5-nitrophenyl)amino)-3-ethoxy-, ethyl ester56395-51-82-Propenoic acid, 3-[(2-chloro-5-nitrophenyl)amino]-3-ethoxy-, ethyl esterRefChem:266326Ethyl 3-((2-chloro-5-nitrophenyl)amino)-3-ethoxyacrylate
Database identifiers
- CAS
56395-51-8- PubChem CID
- 6436610
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 93.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 397
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Propenoic acid, 3-[(2-chloro-5-nitrophenyl)amino]-3-ethoxy-, ethyl ester: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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