Basic information
- CAS
5439-32-7- Standard SMILES
CCCCCCNC(=O)CBr- InChIKey
AKLXGEYCFUSVDD-UHFFFAOYSA-N- Molecular formula
- C8H16BrNO
- Average molar mass
- 222.12 g/mol
- Monoisotopic mass
- 221.04153
Names & identifiers
- Preferred name
- 2-Bromo-n-hexylacetamide
- IUPAC
- 2-bromo-N-hexylacetamide
Names & synonyms
2-bromo-n-hexylacetamide5439-32-7NSC15096Acetamide,2-bromo-N-hexyl-Bromo-N-hexylethanimidic acid2-Bromo-N-hexylethanimidic acidSCHEMBL14621023DTXSID60969503NSC-15096AKOS012991894DS-009528
Database identifiers
- CAS
5439-32-7- PubChem CID
- 225547
- DTXSID
DTXSID60969503
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 106
Experimental & physicochemical properties
LogP2.18
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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