| CAS Number | 1153002-90-4 |
| Catalog Number | AG000GKW(AGN-PC-06S6SH) |
| Chemical Name | 6-Bromo-4-chloro-2,8-dimethylquinoline |
| IUPAC Name | 6-bromo-4-chloro-2,8-dimethylquinoline |
| InChI | InChI=1S/C11H9BrClN/c1-6-3-8(12)5-9-10(13)4-7(2)14-11(6)9/h3-5H,1-2H3 |
| InChI Key | YJTIVPXNBMXIJP-UHFFFAOYSA-N |
| MDL Number | MFCD12114952 |
| Molecular Formula | C11H9BrClN |
| Molecular Weight | 270.5529 |
| SMILES | CC1=NC2=C(C=C(C=C2C)Br)C(Cl)=C1 |
| Synonyms | 6-Bromo-4-chloro-2,8-dimethylquinoline,
1153002-90-4,
SCHEMBL17502184,
CTK8E5361,
DTXSID30656296,
MFCD12114952,
ZINC36075633,
AKOS009865827,
RT-017126,
Quinoline, 6-bromo-4-chloro-2,8-dimethyl-,
T6173,
EN300-83968,
6-Bromo-4-chloro-2,8-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