4-(Chloromethyl)pyridine-3-carbonitrile hydrochloride
Basic information
- CAS
1620645-97-7- Standard SMILES
Cl.N#Cc1cnccc1CCl- InChIKey
IPMAQNBYPCLRTA-UHFFFAOYSA-N- Molecular formula
- C7H6Cl2N2
- Average molar mass
- 189.04 g/mol
- Monoisotopic mass
- 187.9908036
Names & identifiers
- Preferred name
- 4-(Chloromethyl)pyridine-3-carbonitrile hydrochloride
- IUPAC
- 4-(chloromethyl)pyridine-3-carbonitrile;hydrochloride
- English name
- 4-(chloromethyl)pyridine-3-carbonitrile hydrochloride
- Molecular formula
- C7H6Cl2N2
- Molecular weight
- 189.04194
Names & synonyms
1620645-97-74-(chloromethyl)pyridine-3-carbonitrile hydrochloride4-(Chloromethyl)nicotinonitrile hydrochloride4-(chloromethyl)pyridine-3-carbonitrile;hydrochlorideSCHEMBL15905458VPC64597AT181884-(CHLOROMETHYL)NICOTINONITRILE HCL4-(Chloromethyl)nicotinonitrilehydrochlorideEN300-2622834-(Chloromethyl)nicotinonitrile (hydrochloride)
Database identifiers
- CAS
1620645-97-7- PubChem CID
- 90304533
- EC Number
- 881-123-4
Properties
Computed structural properties
- Topological polar surface area
- 36.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 149
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…