| CAS Number | 1367706-85-1 |
| Catalog Number | AG00HUOS(AGN-PC-0WR1QG) |
| Chemical Name | 2-Hydroxy-4,8-dimethyl-7-bromo-quinoline |
| IUPAC Name | 7-bromo-4,8-dimethyl-1H-quinolin-2-one |
| InChI | InChI=1S/C11H10BrNO/c1-6-5-10(14)13-11-7(2)9(12)4-3-8(6)11/h3-5H,1-2H3,(H,13,14) |
| InChI Key | SGZDTRWYFQYXKH-UHFFFAOYSA-N |
| MDL Number | MFCD21647766 |
| Molecular Formula | C11H10BrNO |
| Molecular Weight | 252.1072 |
| SMILES | Oc1cc(C)c2c(n1)c(C)c(cc2)Br |
| Synonyms | 2-Hydroxy-4,8-dimethyl-7-bromo-quinoline,
1367706-85-1,
MFCD21647766,
ZINC95919758,
FCH1566433,
OR309387,
T6378,
2-Hydroxy-4,8-dimethyl-7-bromoquinoline,
|
| Complexity | 287 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 250.995g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 252.111g/mol |
| Monoisotopic Mass | 250.995g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number