| CAS Number | 1207747-91-8 |
| Catalog Number | AG0095UN(AGN-PC-0WCYU1) |
| Chemical Name | 7-bromo-3-(difluoromethyl)quinoline |
| IUPAC Name | 7-bromo-3-(difluoromethyl)quinoline |
| InChI | InChI=1S/C10H6BrF2N/c11-8-2-1-6-3-7(10(12)13)5-14-9(6)4-8/h1-5,10H |
| InChI Key | XFCHZDIUMNTBBP-UHFFFAOYSA-N |
| MDL Number | MFCD26728199 |
| Molecular Formula | C10H6BrF2N |
| Molecular Weight | 258.0621 |
| SMILES | FC(C1=CC2=CC=C(Br)C=C2N=C1)F |
| Synonyms | 7-Bromo-3-(difluoromethyl)quinoline,
1207747-91-8,
SCHEMBL1002281,
MFCD26728199,
ZINC107268046,
Quinoline,7-bromo-3-(difluoromethyl)-,
AS-49640,
|
| Complexity | 201 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 256.965g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.066g/mol |
| Monoisotopic Mass | 256.965g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number