Basic information
- CAS
7705-63-7- Standard SMILES
O=S(=O)(c1ccccc1)c1ccc(CBr)cc1- InChIKey
HBKDLRFVBAEDCF-UHFFFAOYSA-N- Molecular formula
- C13H11BrO2S
- Average molar mass
- 311.2 g/mol
- Monoisotopic mass
- 309.96631269
Names & identifiers
- Preferred name
- 1-(Bromomethyl)-4-(phenylsulfonyl)benzene
- IUPAC
- 1-(benzenesulfonyl)-4-(bromomethyl)benzene
- English name
- 4-(broMoMethyl)phenyl phenyl sulfone
- Molecular formula
- C13H11BrO2S
- Molecular weight
- 311.19
Names & synonyms
1-(bromomethyl)-4-(phenylsulfonyl)benzene1-(benzenesulfonyl)-4-(bromomethyl)benzene7705-63-7NSC98995SCHEMBL22172004-(phenylsulfonyl)benzyl bromideDTXSID60294963HBKDLRFVBAEDCF-UHFFFAOYSA-NNSC-989951-bromomethyl-4-phenylsulfonyl-benzeneAKOS0252957551-Bromomethyl-4-phenylsulphonyl benzene
Show more names
4-(broMoMethyl)phenyl phenyl sulfoneBenzene, 1-(bromomethyl)-4-(phenylsulfonyl)-
DA-30688
Database identifiers
- CAS
7705-63-7- PubChem CID
- 264100
- DTXSID
DTXSID60294963
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 320
Chemistry & industry
Suppliers2 total
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
河北唯特医药科技有限公司13180081292 13180081292 · [email protected]
Related reactions
5 records
Compound notes
Loading…