Basic information
- Standard SMILES
N#Cc1ccccc1SBr- InChIKey
BCPVUACRTZGZNC-UHFFFAOYSA-N- Molecular formula
- C7H4BrNS
- Average molar mass
- 214.08 g/mol
Names & identifiers
- Preferred name
- 2-Cyanobenzenesulfenyl bromide
- IUPAC
- (2-cyanophenyl) thiohypobromite
Names & synonyms
2-cyanobenzenesulfenyl bromideSCHEMBL7778732BCPVUACRTZGZNC-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 15375484
- Nikkaji
- J1.639.596J
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 49.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 151
Related reactions
4 records
Compound notes
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