Benzamide, 5-bromo-N-butyl-2-hydroxy-3-methyl-
Basic information
- CAS
40912-89-8- Standard SMILES
CCCCNC(=O)c1cc(Br)cc(C)c1O- InChIKey
OXERTUUKTZDQPG-UHFFFAOYSA-N- Molecular formula
- C12H16BrNO2
- Average molar mass
- 286.16 g/mol
- Monoisotopic mass
- 285.03644
Names & identifiers
- Preferred name
- Benzamide, 5-bromo-N-butyl-2-hydroxy-3-methyl-
- IUPAC
- 5-bromo-N-butyl-2-hydroxy-3-methylbenzamide
Names & synonyms
5-Bromo-N-butyl-2-hydroxy-3-methylbenzamideBRN 210243240912-89-8BENZAMIDE, 5-BROMO-N-BUTYL-2-HYDROXY-3-METHYL-DTXSID50193916RefChem:321879DTXCID90116407DB-368614
Database identifiers
- CAS
40912-89-8- PubChem CID
- 38710
- DTXSID
DTXSID50193916- Nikkaji
- J1.561.904J
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 235
Experimental & physicochemical properties
LogP4.21
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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