| CAS Number | 1065093-22-2 |
| Catalog Number | AG00IWR5(AGN-PC-0WAZLZ) |
| Chemical Name | 4,8-Dichloro-6-(trifluoromethyl)quinoline |
| IUPAC Name | 4,8-dichloro-6-(trifluoromethyl)quinoline |
| InChI | InChI=1S/C10H4Cl2F3N/c11-7-1-2-16-9-6(7)3-5(4-8(9)12)10(13,14)15/h1-4H |
| InChI Key | KIFUFTJYLJCEEE-UHFFFAOYSA-N |
| MDL Number | MFCD12827783 |
| Molecular Formula | C10H4Cl2F3N |
| Molecular Weight | 266.0467 |
| SMILES | ClC=2(C1(=NC=CC(=C1C=C(C=2)C(F)(F)F)Cl)) |
| Synonyms | 4,8-dichloro-6-(trifluoromethyl)quinoline,
1065093-22-2,
dichlorotrifluoromethylquinoline,
CTK6H3548,
KS-00001Q4D,
ZX-RL000054,
MFCD12827783,
SBB102983,
ZINC40566622,
AKOS005073039,
GD-0001,
RP14941,
PC200182,
AJ-103606,
TR-064911,
|
| Complexity | 259 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 264.967g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 266.044g/mol |
| Monoisotopic Mass | 264.967g/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
Certificate of Analysis
Lot Number