| CAS Number | 1189106-43-1 |
| Catalog Number | AG0080S4(AGN-PC-0WQUC7) |
| Chemical Name | 4-Bromo-7,8-Difluoroquinoline |
| IUPAC Name | 4-bromo-7,8-difluoroquinoline |
| InChI | InChI=1S/C9H4BrF2N/c10-6-3-4-13-9-5(6)1-2-7(11)8(9)12/h1-4H |
| InChI Key | XMRWACGSQHZGJV-UHFFFAOYSA-N |
| MDL Number | MFCD12674974 |
| Molecular Formula | C9H4BrF2N |
| Molecular Weight | 244.0356 |
| SMILES | Fc1ccc2c(c1F)nccc2Br |
| Synonyms | 4-Bromo-7,8-difluoroquinoline,
1189106-43-1,
SCHEMBL18281191,
CTK8E4905,
DTXSID60670920,
MFCD12674974,
ZINC36075571,
DB-061443,
RT-016957,
FT-0717538,
T6244,
|
| Complexity | 191 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.95g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.039g/mol |
| Monoisotopic Mass | 242.95g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number