Basic information
- Standard SMILES
CCCCCC(=O)Br- InChIKey
NIPYIXMXODGEES-UHFFFAOYSA-N- Molecular formula
- C6H11BrO
- Average molar mass
- 179.05 g/mol
- Monoisotopic mass
- 177.99933
Names & identifiers
- Preferred name
- Hexanoyl bromide
- IUPAC
- hexanoyl bromide
Names & synonyms
hexanoyl bromidehexanoylbromid51499-41-3SCHEMBL873174SCHEMBL8903125DTXSID80530092NIPYIXMXODGEES-UHFFFAOYSA-N
Database identifiers
- CAS
51499-41-3- PubChem CID
- 13226800
- DTXSID
DTXSID80530092- Nikkaji
- J1.882.810C
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 70
Related reactions
16 records
Linked notes
Loading…