| CAS Number | 132132-54-8 |
| Catalog Number | AG00AGTY(AGN-PC-0N4Y1J) |
| Chemical Name | 7-fluoro-2-phenylquinoline-4-carboxylic acid |
| IUPAC Name | 7-fluoro-2-phenylquinoline-4-carboxylic acid |
| InChI | InChI=1S/C16H10FNO2/c17-11-6-7-12-13(16(19)20)9-14(18-15(12)8-11)10-4-2-1-3-5-10/h1-9H,(H,19,20) |
| InChI Key | MUTUDFZNRULRAE-UHFFFAOYSA-N |
| MDL Number | MFCD08444879 |
| Molecular Formula | C16H10FNO2 |
| Molecular Weight | 267.2545 |
| SMILES | OC(C1=C2C(C=C(C=C2)F)=NC(C2=CC=CC=C2)=C1)=O |
| Synonyms | 7-fluoro-2-phenylquinoline-4-carboxylic acid,
132132-54-8,
AC1Q72NK,
CTK7C1486,
ZINC20080951,
AKOS000264202,
MCULE-2785977004,
NE13895,
SC-61061,
EN300-53754,
4-QUINOLINECARBOXYLIC ACID,7-FLUORO-2-PHENYL-,
CID10468173,
7-fluoro-2-phenyl-quinoline-4-carboxylic Acid,
|
| Complexity | 356 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 267.259g/mol |
| Monoisotopic Mass | 267.07g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 50.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number