Basic information
- CAS
50343-42-5- Standard SMILES
CC(CCOC(=O)CBr)OC(=O)CBr- InChIKey
NYPDUQAJJSMBNC-UHFFFAOYSA-N- Molecular formula
- C8H12Br2O4
- Average molar mass
- 331.99 g/mol
- Monoisotopic mass
- 329.91023
Names & identifiers
- Preferred name
- 3-(2-Bromoacetyl)oxybutyl 2-bromoacetate
- IUPAC
- 3-(2-bromoacetyl)oxybutyl 2-bromoacetate
Names & synonyms
50343-42-53-(2-bromoacetyl)oxybutyl 2-bromoacetateNSC406062SCHEMBL21883834DTXSID10324224Butane-1,3-diyl bis(bromoacetate)NSC-406062
Database identifiers
- CAS
50343-42-5- PubChem CID
- 347399
- DTXSID
DTXSID10324224
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 196
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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