Basic information
- Standard SMILES
COc1cccc([N+](=O)[O-])c1CC#N- InChIKey
ULYNKRWNPIYQCQ-UHFFFAOYSA-N- Molecular formula
- C9H8N2O3
- Average molar mass
- 192.17 g/mol
Names & identifiers
- Preferred name
- 2-(2-Methoxy-6-nitrophenyl)acetonitrile
- IUPAC
- 2-(2-methoxy-6-nitrophenyl)acetonitrile
Names & synonyms
20876-27-12-(2-methoxy-6-nitrophenyl)acetonitrile(2-Methoxy-6-nitrophenyl)acetonitrile2-Methoxy-6-nitrophenylacetonitrile2-(2-methoxy-6-nitro-phenyl)acetonitrileBenzeneacetonitrile, 2-methoxy-6-nitro-MFCD07781315(2-Methoxy-6-nitrophenyl)-acetonitrileSCHEMBL942641SCHEMBL311430786-methoxy-2-nitrophenylacetonitrileAKOS006284425
Show more names
PB22068(2-methoxy-6-nitro-phenyl)-acetonitrile(2-Methoxy-6-nitrophenyl)acetonitrile #Phenylmethyl cyanide, 2-methoxy-6-nitro-SY036052DB-344598CS-0316353P10496
Database identifiers
- PubChem CID
- 555018
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 78.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 253
Related reactions
6 records
Compound notes
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