| CAS Number | 1242260-88-3 |
| Catalog Number | AG009VZB |
| Chemical Name | 4,8-Dibromoquinoline-3-carbonitrile |
| IUPAC Name | 4,8-dibromoquinoline-3-carbonitrile |
| InChI | InChI=1S/C10H4Br2N2/c11-8-3-1-2-7-9(12)6(4-13)5-14-10(7)8/h1-3,5H |
| InChI Key | XTFRWBMKBDZJHG-UHFFFAOYSA-N |
| MDL Number | MFCD15527484 |
| Molecular Formula | C10H4Br2N2 |
| Molecular Weight | 311.9602 |
| SMILES | N#Cc1cnc2c(c1Br)cccc2Br |
| Synonyms | 4,8-Dibromoquinoline-3-carbonitrile,
1242260-88-3,
DTXSID40677851,
MFCD15527484,
ZINC47913001,
FCH1391152,
OR309347,
T6333,
|
| Complexity | 260 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 311.872g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 311.964g/mol |
| Monoisotopic Mass | 309.874g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 36.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number