7-Bromobicyclo[2.2.1]hept-2-yl acetate
Basic information
- CAS
10389-63-6- Standard SMILES
CC(=O)OC1CC2CCC1C2Br- InChIKey
DPSPXRTZVZNQIK-UHFFFAOYSA-N- Molecular formula
- C9H13BrO2
- Average molar mass
- 233.1 g/mol
- Monoisotopic mass
- 232.00989
Names & identifiers
- Preferred name
- 7-Bromobicyclo[2.2.1]hept-2-yl acetate
- IUPAC
- (7-bromo-2-bicyclo[2.2.1]heptanyl) acetate
Names & synonyms
10389-63-6NSC 1105797-bromobicyclo[2.2.1]hept-2-yl acetateNSC110579DTXSID80296626NSC-1105797-BROMOBICYCLO[2.2.1]HEPTAN-2-YL ACETATE
Database identifiers
- CAS
10389-63-6- PubChem CID
- 269442
- DTXSID
DTXSID80296626
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 205
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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