Basic information
- Standard SMILES
Cl.O=C(Cl)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1- InChIKey
UPOWNXWESATVHV-UHFFFAOYSA-N- Molecular formula
- C12H14Cl2N2O3
- Average molar mass
- 305.15 g/mol
- Monoisotopic mass
- 304.0381477
Names & identifiers
- Preferred name
- 1-(4-Nitrophenyl)piperidine-4-carboxylic acid chloride hydrochloride
- IUPAC
- 1-(4-nitrophenyl)piperidine-4-carbonyl chloride;hydrochloride
Names & synonyms
SCHEMBL3568155UPOWNXWESATVHV-UHFFFAOYSA-N1-(4-nitrophenyl)piperidine-4-carboxylic acid chloride hydrochloride
Database identifiers
- PubChem CID
- 87542001
Properties
Computed structural properties
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 316
Related reactions
2 records
Compound notes
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