5-Bromo-2-chloro-6-phenylnicotinonitrile
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Basic information
- CAS
1228182-75-9- Standard SMILES
N#Cc1cc(Br)c(-c2ccccc2)nc1Cl- InChIKey
RFODHGDYXLVIQM-UHFFFAOYSA-N- Molecular formula
- C12H6BrClN2
- Average molar mass
- 293.54 g/mol
- Monoisotopic mass
- 291.94029
Names & identifiers
- Preferred name
- 5-Bromo-2-chloro-6-phenylnicotinonitrile
- IUPAC
- 5-bromo-2-chloro-6-phenylpyridine-3-carbonitrile
- English name
- 5-Bromo-2-chloro-6-phenylpyridine-3-carbonitrile
- Molecular formula
- C12H6BrClN2
- Molecular weight
- 293.55
Names & synonyms
5-Bromo-2-chloro-6-phenylnicotinonitrile1228182-75-95-bromo-2-chloro-6-phenylpyridine-3-carbonitrileMFCD16622787AKOS015834073DE-0722CS-04563813-Pyridinecarbonitrile, 5-bromo-2-chloro-6-phenyl-5-bromo-2-chloro-6-phenyl-pyridine-3-carbonitrile5-Bromo-2-chloro-6-phenylnicotinonitrile 95+%
Database identifiers
- CAS
1228182-75-9- PubChem CID
- 49757540
Properties
Computed structural propertiesFilling in
- XLogP
- 3.9
- Topological polar surface area
- 36.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 282
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HS Code
- 2933399990 · 2933399990
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
- hs_code
- 2933399990
- 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
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