Basic information
- CAS
5458-11-7- Standard SMILES
BrCC(Br)Cc1ccc2c(c1)OCO2- InChIKey
OUMIAFCYDYHQRL-UHFFFAOYSA-N- Molecular formula
- C10H10Br2O2
- Average molar mass
- 321.99 g/mol
- Monoisotopic mass
- 319.90475
Names & identifiers
- Preferred name
- 5-(2,3-Dibromopropyl)-1,3-benzodioxole
- IUPAC
- 5-(2,3-dibromopropyl)-1,3-benzodioxole
Names & synonyms
NSC237325458-11-7NSC-23732
Database identifiers
- CAS
5458-11-7- PubChem CID
- 229779
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 189
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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