Basic information
- CAS
130707-32-3- Standard SMILES
N#Cc1c(Nc2ccc(Cl)cc2)ccnc1N- InChIKey
XEKCWFOWFZFELV-UHFFFAOYSA-N- Molecular formula
- C12H9ClN4
- Average molar mass
- 244.68 g/mol
- Monoisotopic mass
- 244.051574
Names & identifiers
- Preferred name
- 3-Pyridinecarbonitrile, 2-amino-4-((4-chlorophenyl)amino)-
- IUPAC
- 2-amino-4-(4-chloroanilino)pyridine-3-carbonitrile
- English name
- 2-amino-4-[(4-chlorophenyl)amino]pyridine-3-carbonitrile
- Molecular formula
- C12H9ClN4
- Molecular weight
- 0
Names & synonyms
130707-32-3BRN 43187613-Pyridinecarbonitrile, 2-amino-4-((4-chlorophenyl)amino)-2-Amino-4-((4-chlorophenyl)amino)-3-pyridinecarbonitrileDTXSID40156691RefChem:282055DTXCID00791822-amino-4-(4-chloroanilino)pyridine-3-carbonitrile2-AMINO-4-[(4-CHLOROPHENYL)AMINO]PYRIDINE-3-CARBONITRILE
Database identifiers
- CAS
130707-32-3- PubChem CID
- 3076321
- DTXSID
DTXSID40156691
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 74.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 292
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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