| CAS Number | 1070879-60-5 |
| Catalog Number | AG007TFO(AGN-PC-0WNVAZ) |
| Chemical Name | 4-Bromo-2,6,8-trimethylquinoline |
| IUPAC Name | 4-bromo-2,6,8-trimethylquinoline |
| InChI | InChI=1S/C12H12BrN/c1-7-4-8(2)12-10(5-7)11(13)6-9(3)14-12/h4-6H,1-3H3 |
| InChI Key | ZLLFZRRHKAPRNV-UHFFFAOYSA-N |
| MDL Number | MFCD11505145 |
| Molecular Formula | C12H12BrN |
| Molecular Weight | 250.1344 |
| SMILES | CC1=C2N=C(C)C=C(Br)C2=CC(C)=C1 |
| Synonyms | 4-Bromo-2,6,8-trimethylquinoline,
1070879-60-5,
CTK4A4989,
DTXSID70653709,
MFCD11505145,
ZINC32099877,
4-bromo-2, 6, 8-trimethylquinoline,
AKOS022889570,
FCH1404188,
OR309294,
RT-016888,
T6148,
4-Bromo-2,6,8-trimethylquinoline, AldrichCPR,
|
| Complexity | 207 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 249.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 250.139g/mol |
| Monoisotopic Mass | 249.015g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
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