Basic information
- Standard SMILES
N#Cc1c(C2CC2)cccc1[N+](=O)[O-]- InChIKey
XZURHUYAPXRFGI-UHFFFAOYSA-N- Molecular formula
- C10H8N2O2
- Average molar mass
- 188.18 g/mol
Names & identifiers
- Preferred name
- 2-Nitro-6-cyclopropylbenzonitrile
- IUPAC
- 2-cyclopropyl-6-nitrobenzonitrile
Names & synonyms
2-nitro-6-cyclopropylbenzonitrileSCHEMBL12500991XZURHUYAPXRFGI-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 68296405
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 284
Related reactions
2 records
Compound notes
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