Basic information
- CAS
58882-68-1- Standard SMILES
Cc1cc(O)ccc1[N+](=O)[O-].Cc1cc([N+](=O)[O-])ccc1O- InChIKey
FVVBEMKXRUJJFF-UHFFFAOYSA-N- Molecular formula
- C14H14N2O6
- Average molar mass
- 306.27 g/mol
- Monoisotopic mass
- 306.08518617
Names & identifiers
- Preferred name
- p-Nitrocresol
- IUPAC
- 2-methyl-4-nitrophenol;3-methyl-4-nitrophenol
Names & synonyms
P-NITROCRESOL58882-68-1DTXSID40207591RefChem:1094203DTXCID90130082SCHEMBL294312052-Methyl-4-nitrophenol--3-methyl-4-nitrophenol (1/1)
Database identifiers
- CAS
58882-68-1- PubChem CID
- 42866
- DTXSID
DTXSID40207591
Properties
Computed structural properties
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 309
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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