Basic information
- Standard SMILES
O=S(=O)(C=C1CCCCCC1)CBr- InChIKey
DDNFLWPYDIATEW-UHFFFAOYSA-N- Molecular formula
- C9H15BrO2S
- Average molar mass
- 267.19 g/mol
- Monoisotopic mass
- 265.99761
Names & identifiers
- Preferred name
- Bromomethanesulfonylmethylene cycloheptane
- IUPAC
- bromomethylsulfonylmethylidenecycloheptane
Names & synonyms
SCHEMBL10924771DDNFLWPYDIATEW-UHFFFAOYSA-Nbromomethanesulfonylmethylene cycloheptane
Database identifiers
- PubChem CID
- 13657290
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 264
Related reactions
2 records
Compound notes
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