Basic information
- CAS
5463-71-8- Standard SMILES
CC(Br)Cc1ccc2c(c1)OCO2- InChIKey
HRTRXPZBWBBZNP-UHFFFAOYSA-N- Molecular formula
- C10H11BrO2
- Average molar mass
- 243.1 g/mol
- Monoisotopic mass
- 241.99424
Names & identifiers
- Preferred name
- 1,3-Benzodioxole, 5-(2-bromopropyl)-
- IUPAC
- 5-(2-bromopropyl)-1,3-benzodioxole
- English name
- Bromosaffrole
- Molecular formula
- C10H11BrO2
- Molecular weight
- 243.1
Names & synonyms
5463-71-81,3-Benzodioxole, 5-(2-bromopropyl)-RefChem:10526995-(2-bromopropyl)-1,3-benzodioxole5-(2-Bromopropyl)benzo[d][1,3]dioxole5-(2-bromopropyl)-1,3-dioxaindane5-(2-BROMOPROPYL)-2H-1,3-BENZODIOXOLE2-BromosaffroleNSC15658AI3-20997SCHEMBL25075019SCHEMBL27469019
Show more names
Bromosaffrole
SCHEMBL30942654NSC 15658NSC-15658EN300-1997111
Database identifiers
- CAS
5463-71-8- PubChem CID
- 95504
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 174
Chemistry & industry
Suppliers7 total
Zhejiang J&C Biological Technology Co.,Limited+1-2135480471 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海昕凯医药科技有限公司21-619849051-1 18521059765 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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