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Basic information
- Standard SMILES
CC1(C)Nc2ccc(Br)c(CO)c2NC1=O- InChIKey
YXCXIYOCKUAILC-UHFFFAOYSA-N- Molecular formula
- C11H13BrN2O2
- Average molar mass
- 285.14 g/mol
- Monoisotopic mass
- 284.01604
Names & identifiers
- Preferred name
- 7-Bromo-8-hydroxymethyl-3,3-dimethyl-3,4-dihydro-1H-quinoxalin-2-one
- IUPAC
- 7-bromo-8-(hydroxymethyl)-3,3-dimethyl-1,4-dihydroquinoxalin-2-one
Names & synonyms
SCHEMBL1917451YXCXIYOCKUAILC-UHFFFAOYSA-N7-Bromo-8-hydroxymethyl-3,3-dimethyl-3,4-dihydro-1H-quinoxalin-2-one
Database identifiers
- PubChem CID
- 57672000
Properties
Computed structural propertiesFilling in
- XLogP
- 1.3
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 296
Related reactions
12 records
Compound notes
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