| CAS Number | 94025-76-0 |
| Catalog Number | AG003N4I(AGN-PC-05J2KX) |
| Chemical Name | 6-Bromo-4-phenyl-3,4-dihydro-2(1H)-quinolinone |
| IUPAC Name | 6-bromo-4-phenyl-3,4-dihydro-1H-quinolin-2-one |
| InChI | InChI=1S/C15H12BrNO/c16-11-6-7-14-13(8-11)12(9-15(18)17-14)10-4-2-1-3-5-10/h1-8,12H,9H2,(H,17,18) |
| InChI Key | NGZWCCIWYKYWDL-UHFFFAOYSA-N |
| MDL Number | MFCD12031575 |
| Molecular Formula | C15H12BrNO |
| Molecular Weight | 302.1659 |
| SMILES | BrC=1C=C2C(CC(NC2=CC1)=O)C1=CC=CC=C1 |
| Synonyms | 94025-76-0,
6-Bromo-3,4-dihydro-4-phenyl-carbostyril,
6-bromo-4-phenyl-3,4-dihydroquinolin-2(1H)-one,
6-Bromo-4-phenyl-3,4-dihydro-2(1H)-quinolinone,
SCHEMBL14094474,
CTK8F7082,
DTXSID30675725,
MFCD12031575,
AKOS030228792,
KS-000001G0,
6-bromo-3,4-dihyclro-4-phenyl-carbostyril,
FT-0663711,
6-Bromo-3,4-dihydro-4-phenyl-2(1H)-quinolinone,
6-bromo-4-phenyl-3,4-dihydro-1H-quinolin-2-one,
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| Complexity | 314 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 301.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 302.171g/mol |
| Monoisotopic Mass | 301.01g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number