Basic information
- CAS
329934-29-4- Standard SMILES
Cc1ccc(N=Cc2cc([N+](=O)[O-])ccc2O)cc1Cl- InChIKey
XQVRXBHMHAZMFN-UHFFFAOYSA-N- Molecular formula
- C14H11ClN2O3
- Average molar mass
- 290.7 g/mol
- Monoisotopic mass
- 290.0458199
Names & identifiers
- Preferred name
- 2-((3-Chloro-4-methyl-phenylimino)-methyl)-4-nitro-phenol
- IUPAC
- 2-[(3-chloro-4-methylphenyl)iminomethyl]-4-nitrophenol
Names & synonyms
AKOS005154373AKOS024274997ST0096092-((3-CHLORO-4-METHYL-PHENYLIMINO)-METHYL)-4-NITRO-PHENOL2-[(1E)-2-(3-chloro-4-methylphenyl)-2-azavinyl]-4-nitrophenol
Database identifiers
- CAS
329934-29-4- PubChem CID
- 690792
- EC Number
- 141-526-1
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 372
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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