Basic information
- CAS
17179-50-9- Standard SMILES
CCCCNCC(=O)Nc1c(C)cc(Br)cc1C- InChIKey
SQEHTTLACAWHEB-UHFFFAOYSA-N- Molecular formula
- C14H21BrN2O
- Average molar mass
- 313.23 g/mol
- Monoisotopic mass
- 312.08373
Names & identifiers
- Preferred name
- 2',6'-Acetoxylidide, 4'-bromo-2-(butylamino)-
- IUPAC
- N-(4-bromo-2,6-dimethylphenyl)-2-(butylamino)acetamide
Names & synonyms
2',6'-ACETOXYLIDIDE, 4'-BROMO-2-(BUTYLAMINO)-A 14124'-Bromo-2-(butylamino)-2',6'-acetoxylidide17179-50-9DTXSID80169164RefChem:241080DTXCID4091655N-(4-Bromo-2,6-dimethylphenyl)-N~2~-butylglycinamide
Database identifiers
- CAS
17179-50-9- PubChem CID
- 28375
- DTXSID
DTXSID80169164
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 248
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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