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Basic information
- CAS
59908-77-9- Standard SMILES
COc1ccc(OC)c(C(=O)CNC(=O)CCl)c1- InChIKey
FGAJXUVYQBZJHH-UHFFFAOYSA-N- Molecular formula
- C12H14ClNO4
- Average molar mass
- 271.69 g/mol
- Monoisotopic mass
- 271.0611356
Names & identifiers
- Preferred name
- 2-Chloro-N-(b-oxo-2,5-dimethoxy-phenylethyl)-acetamid
- IUPAC
- 2-chloro-N-[2-(2,5-dimethoxyphenyl)-2-oxoethyl]acetamide
Names & synonyms
59908-77-9RefChem:4702432-Chloro-N-(b-oxo-2,5-dimethoxy-phenylethyl)-acetamid813-608-32-chloro-n-(beta-oxo-2,5-dimethoxy phenethyl)-acetamideX4Z8TB7GBASCHEMBL5844239FGAJXUVYQBZJHH-UHFFFAOYSA-N2-chloro-N-[2-(2,5-dimethoxyphenyl)-2-oxoethyl]acetamideAcetamide, 2-chloro-N-[2-(2,5-dimethoxyphenyl)-2-oxoethyl]-
Database identifiers
- CAS
59908-77-9- PubChem CID
- 11637604
- UNII
- X4Z8TB7GBA
- EC Number
- 813-608-3
Properties
Computed structural propertiesFilling in
- XLogP
- 1.5
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 298
Related reactions
1 records
Compound notes
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