| CAS Number | 1156275-57-8 |
| Catalog Number | AG000G9W(AGN-PC-0WQXFE) |
| Chemical Name | Quinoline, 8-bromo-4-chloro-2,6-dimethyl- |
| IUPAC Name | 8-bromo-4-chloro-2,6-dimethylquinoline |
| InChI | InChI=1S/C11H9BrClN/c1-6-3-8-10(13)5-7(2)14-11(8)9(12)4-6/h3-5H,1-2H3 |
| InChI Key | XKEXCBVAJCIAMY-UHFFFAOYSA-N |
| MDL Number | MFCD12115058 |
| Molecular Formula | C11H9BrClN |
| Molecular Weight | 270.5529 |
| SMILES | BrC=1C=C(C=C2C(=CC(=NC12)C)Cl)C |
| Synonyms | 8-Bromo-4-chloro-2,6-dimethylquinoline,
1156275-57-8,
CTK8E5556,
DTXSID10656310,
MFCD12115058,
ZINC36075646,
AKOS009867874,
RT-017225,
Quinoline, 8-bromo-4-chloro-2,6-dimethyl-,
T6175,
8-Bromo-4-chloro-2,6-dimethylquinoline, AldrichCPR,
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 268.961g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.554g/mol |
| Monoisotopic Mass | 268.961g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.3 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
6.1
|
|
Hazard statements
|
H301-H413
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P301+P310
|
|
UN Code
|
UN 2811
|
Certificate of Analysis
Lot Number