5-Acetamido-4-methyl-2-nitrobenzoic acid
Basic information
- CAS
6632-23-1- Standard SMILES
CC(=O)Nc1cc(C(=O)O)c([N+](=O)[O-])cc1C- InChIKey
IGZVJBLUWSNLCT-UHFFFAOYSA-N- Molecular formula
- C10H10N2O5
- Average molar mass
- 238.2 g/mol
- Monoisotopic mass
- 238.05897142
Names & identifiers
- Preferred name
- 5-Acetamido-4-methyl-2-nitrobenzoic acid
- IUPAC
- 5-acetamido-4-methyl-2-nitrobenzoic acid
- English name
- 2-Nitro-5-acetylamino-4-methylbenzoic acid
- Molecular formula
- C10H10N2O5
- Molecular weight
- 238.2
Names & synonyms
6632-23-15-acetamido-4-methyl-2-nitrobenzoic acid5-(acetylamino)-4-methyl-2-nitrobenzoic acidNSC57773Benzoic acid,5-(acetylamino)-4-methyl-2-nitro-DTXSID50288836ALBB-036628NSC-57773DS-007195H493742-Nitro-5-acetylamino-4-methylbenzoic acidBenzoic acid, 5-(acetylamino)-4-methyl-2-nitro-
Database identifiers
- CAS
6632-23-1- PubChem CID
- 245644
- DTXSID
DTXSID50288836
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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