2-Amino-5-methylphenyl 2-bromophenyl ketone
Basic information
- CAS
7007-15-0- Standard SMILES
Cc1ccc(N)c(C(=O)c2ccccc2Br)c1- InChIKey
PYJAVOUJSYKIFQ-UHFFFAOYSA-N- Molecular formula
- C14H12BrNO
- Average molar mass
- 290.15 g/mol
- Monoisotopic mass
- 289.01023
Names & identifiers
- Preferred name
- 2-Amino-5-methylphenyl 2-bromophenyl ketone
- IUPAC
- (2-amino-5-methylphenyl)-(2-bromophenyl)methanone
Names & synonyms
ST50759268(2-amino-5-methylphenyl)(2-bromophenyl)methanoneDTXSID90411787AKOS0023132232-amino-5-methylphenyl 2-bromophenyl ketone
Database identifiers
- CAS
7007-15-0- PubChem CID
- 5231024
- DTXSID
DTXSID90411787
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 281
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Compound notes
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