| CAS Number | 1210275-42-5 |
| Catalog Number | AG0093D8 |
| Chemical Name | 4-Bromo-3-chloro-5,8-difluoroquinoline |
| IUPAC Name | 4-bromo-3-chloro-5,8-difluoroquinoline |
| InChI | InChI=1S/C9H3BrClF2N/c10-8-4(11)3-14-9-6(13)2-1-5(12)7(8)9/h1-3H |
| InChI Key | UISSAMSFPLEPEJ-UHFFFAOYSA-N |
| MDL Number | MFCD13619736 |
| Molecular Formula | C9H3BrClF2N |
| Molecular Weight | 278.4806 |
| SMILES | Clc1cnc2c(c1Br)c(F)ccc2F |
| Synonyms | 4-Bromo-3-chloro-5,8-difluoroquinoline,
1210275-42-5,
DTXSID40672689,
MFCD13619736,
ZINC41702022,
T6301,
|
| Complexity | 219 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 276.911g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 278.481g/mol |
| Monoisotopic Mass | 276.911g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number