Basic information
- CAS
1267467-92-4- Standard SMILES
N#Cc1cncc(-c2ccccc2Cl)c1- InChIKey
PIKAQAXAADFFKN-UHFFFAOYSA-N- Molecular formula
- C12H7ClN2
- Average molar mass
- 214.65 g/mol
- Monoisotopic mass
- 214.0297759
Names & identifiers
- Preferred name
- 5-(2-Chlorophenyl)nicotinonitrile
- IUPAC
- 5-(2-chlorophenyl)pyridine-3-carbonitrile
- English name
- 5-(2-chlorophenyl)pyridine-3-carbonitrile
- Molecular formula
- C12H7ClN2
- Molecular weight
- 214.65
Names & synonyms
5-(2-Chlorophenyl)nicotinonitrile1267467-92-45-(2-chlorophenyl)pyridine-3-carbonitrileDTXSID30744940DB-306152A1-534643-Pyridinecarbonitrile, 5-(2-chlorophenyl)-
Database identifiers
- CAS
1267467-92-4- PubChem CID
- 71303457
- DTXSID
DTXSID30744940
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 36.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 258
Physicochemical properties
- storage temp.
- 2 · 2-8°C
Chemistry & industry
Suppliers1 total
郑州药领医药科技有限公司13526569071 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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