Basic information
- CAS
14299-56-0- Standard SMILES
CCCCC(Br)C(=O)NC(N)=O- InChIKey
UBOMGPOXNJJPEA-UHFFFAOYSA-N- Molecular formula
- C7H13BrN2O2
- Average molar mass
- 237.09 g/mol
- Monoisotopic mass
- 236.01603976
Names & identifiers
- Preferred name
- 2-Bromohexanoylurea
- IUPAC
- 2-bromo-N-carbamoylhexanamide
Names & synonyms
2-bromohexanoylureaDTXSID501030429N-(Aminocarbonyl)-2-bromohexanamide14299-56-0
Database identifiers
- CAS
14299-56-0- PubChem CID
- 12937418
- DTXSID
DTXSID501030429- Nikkaji
- J1.921.606C
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 72.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 173
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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