2-cyano-N-(2-methoxy-4-nitrophenyl)acetamide
Basic information
- CAS
546099-81-4- Standard SMILES
COc1cc([N+](=O)[O-])ccc1NC(=O)CC#N- InChIKey
HBAJOEDSAPHPNU-UHFFFAOYSA-N- Molecular formula
- C10H9N3O4
- Average molar mass
- 235.2 g/mol
- Monoisotopic mass
- 235.05930578
Names & identifiers
- Preferred name
- 2-cyano-N-(2-methoxy-4-nitrophenyl)acetamide
- IUPAC
- 2-cyano-N-(2-methoxy-4-nitrophenyl)acetamide
Names & synonyms
2-cyano-N-(2-methoxy-4-nitrophenyl)acetamide546099-81-42-cyano-N-(2-methoxy-4-nitro-phenyl)acetamideDTXSID201259139BBL029957MFCD03395574STK317966AKOS003800401VS-09532CS-0359200
Database identifiers
- CAS
546099-81-4- PubChem CID
- 4592947
- DTXSID
DTXSID201259139
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 343
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Compound notes
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