Basic information
- Standard SMILES
Cc1cc(Oc2cccc(Cl)c2)ccc1[N+](=O)[O-]- InChIKey
RYAUPODCAXWGBP-UHFFFAOYSA-N- Molecular formula
- C13H10ClNO3
- Average molar mass
- 263.67 g/mol
Names & identifiers
- Preferred name
- 4-(3-Chlorophenoxy)-2-methyl-1-nitrobenzene
- IUPAC
- 4-(3-chlorophenoxy)-2-methyl-1-nitrobenzene
Names & synonyms
4-(3-chlorophenoxy)-2-methyl-1-nitrobenzene862731-11-1SCHEMBL14737306RYAUPODCAXWGBP-UHFFFAOYSA-NMFCD34892125DB-1944454-(3-chloro-phenoxy)-2-methyl-1-nitro-benzene
Database identifiers
- PubChem CID
- 71279596
- Nikkaji
- J2.209.067D
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 294
Related reactions
2 records
Compound notes
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