| CAS Number | 955413-26-0 |
| Catalog Number | AG01BV2Y(AGN-PC-0WCS0Z) |
| Chemical Name | 6-(Trifluoromethyl)quinolin-8-amine |
| IUPAC Name | 6-(trifluoromethyl)quinolin-8-amine |
| InChI | InChI=1S/C10H7F3N2/c11-10(12,13)7-4-6-2-1-3-15-9(6)8(14)5-7/h1-5H,14H2 |
| InChI Key | OWBHAJLHWDFULE-UHFFFAOYSA-N |
| MDL Number | MFCD22627929 |
| Molecular Formula | C10H7F3N2 |
| Molecular Weight | 212.1712 |
| SMILES | FC(C=1C=C2C=CC=NC2=C(C1)N)(F)F |
| Synonyms | 6-trifluoromethyl-8-quinolinamine,
955413-26-0,
6-(trifluoromethyl)quinolin-8-amine,
SCHEMBL5456371,
OWBHAJLHWDFULE-UHFFFAOYSA-N,
6-trifluoromethyl-quinolin-8-ylamine,
AKOS025146784,
ZINC165525598,
8-Quinolinamine, 6-(trifluoromethyl)-,
|
| Complexity | 229 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.175g/mol |
| Monoisotopic Mass | 212.056g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number