Basic information
- CAS
1152999-50-2- Standard SMILES
CCCc1cc(=O)c2cc(Br)cc(C)c2[nH]1- InChIKey
FKSVHGVQWKRDBL-UHFFFAOYSA-N- Molecular formula
- C13H14BrNO
- Average molar mass
- 280.16 g/mol
- Monoisotopic mass
- 279.02588
Names & identifiers
- Preferred name
- 6-Bromo-8-methyl-2-propylquinolin-4(1H)-one
- IUPAC
- 6-bromo-8-methyl-2-propyl-1H-quinolin-4-one
- English name
- 6-Bromo-4-hydroxy-8-methyl-2-propylquinoline
- Molecular formula
- C13H14BrNO
- Molecular weight
- 280.16
Names & synonyms
1152999-50-2DTXSID406562826-Bromo-8-methyl-2-propylquinolin-4(1H)-one6-bromo-8-methyl-2-propyl-1H-quinolin-4-one6-Bromo-4-hydroxy-8-methyl-2-propylquinoline4(1H)-Quinolinone, 6-bromo-8-methyl-2-propyl-
Database identifiers
- CAS
1152999-50-2- PubChem CID
- 43668035
- DTXSID
DTXSID40656282
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 313
Chemistry & industry
Suppliers1 total
BioBlocks Incorporated[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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