5-Hydroxy-4-methyl-2-nitrobenzoic acid
Basic information
- CAS
6632-24-2- Standard SMILES
Cc1cc([N+](=O)[O-])c(C(=O)O)cc1O- InChIKey
VWKYIUHTPODUGT-UHFFFAOYSA-N- Molecular formula
- C8H7NO5
- Average molar mass
- 197.14 g/mol
- Monoisotopic mass
- 197.03242232
Names & identifiers
- Preferred name
- 5-Hydroxy-4-methyl-2-nitrobenzoic acid
- IUPAC
- 5-hydroxy-4-methyl-2-nitrobenzoic acid
Names & synonyms
5-hydroxy-4-methyl-2-nitrobenzoic acid6632-24-25-hydroxy-4-methyl-2-nitro-benzoic acidNSC57776DTXSID70984904NSC-57776DS-009000
Database identifiers
- CAS
6632-24-2- PubChem CID
- 245646
- DTXSID
DTXSID70984904
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 249
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Compound notes
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