Basic information
- CAS
153435-83-7- Standard SMILES
CCCS(=O)(=O)c1cccc(Br)c1- InChIKey
JSWLMTKGJQIASC-UHFFFAOYSA-N- Molecular formula
- C9H11BrO2S
- Average molar mass
- 263.15 g/mol
- Monoisotopic mass
- 261.96631
Names & identifiers
- Preferred name
- 1-Bromo-3-(propylsulfonyl)benzene
- IUPAC
- 1-bromo-3-propylsulfonylbenzene
- English name
- 1-BroMo-3-(propylsulfonyl)benzene
- Molecular formula
- C9H11BrO2S
- Molecular weight
- 263.15
Names & synonyms
1-Bromo-3-(propylsulfonyl)benzene153435-83-71-bromo-3-propylsulfonylbenzeneMFCD213329561-Bromo-3-(propane-1-sulfonyl)benzeneSCHEMBL263686SCHEMBL286051731-bromo-3-propylsulfonyl-benzeneDTXSID30717790JSWLMTKGJQIASC-UHFFFAOYSA-N1-bromo-3-(propane-1-sulfonyl)-benzeneBS-27560
Show more names
Benzene, 1-bromo-3-(propylsulfonyl)-
DB-363420
Database identifiers
- CAS
153435-83-7- PubChem CID
- 56594265
- DTXSID
DTXSID30717790
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
- 13
- Formal charge
- 0
- Complexity
- 243
Physicochemical properties
- Boiling point
- 380.3 · 380.3±34.0 °C(Predicted)
- Density
- 1.458 · 1.458±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers7 total
杭州鸿喜生物医药科技有限公司18989489206 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
杭州博洛科生物科技有限公司13757158499; 13757158499 · [email protected]
上海弘敏医药科技有限公司13651987816 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
4 records
Compound notes
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