| CAS Number | 284664-59-1 |
| Catalog Number | AG00BI02 |
| Chemical Name | 2-Chloro-6-methyl-3-phenylquinoline |
| IUPAC Name | 2-chloro-6-methyl-3-phenylquinoline |
| InChI | InChI=1S/C16H12ClN/c1-11-7-8-15-13(9-11)10-14(16(17)18-15)12-5-3-2-4-6-12/h2-10H,1H3 |
| InChI Key | KVZXVKOSIBJSNI-UHFFFAOYSA-N |
| MDL Number | MFCD00126763 |
| Molecular Formula | C16H12ClN |
| Molecular Weight | 253.7262 |
| SMILES | Cc1ccc2c(c1)cc(c(n2)Cl)c1ccccc1 |
| Synonyms | 2-chloro-6-methyl-3-phenylquinoline,
284664-59-1,
AC1MD0AV,
MLS001143867,
CHEMBL1603164,
CTK6C0381,
DTXSID50381811,
HMS2805K15,
ZINC162776,
MFCD00126763,
AKOS022212848,
OR26992,
ACM284664591,
SMR000473306,
FT-0728750,
T6476,
2-Chloro-6-methyl-3-phenylquinoline, AldrichCPR,
ZINC00162776,
CID2781550,
|
| Complexity | 274 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.066g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.729g/mol |
| Monoisotopic Mass | 253.066g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number