6-Amino-4-(trifluoromethyl)-2(1H)-quinolinone - CAS 328955-57-3
Catalog: |
BB075250 |
Product Name: |
6-Amino-4-(trifluoromethyl)-2(1H)-quinolinone |
CAS: |
328955-57-3 |
Synonyms: |
6-amino-4-trifluoromethylquinolin-2(1H)-one; 6-amino-4-(trifluoromethyl)quinolin-2(1H)-one; 6-AMINO-4-(TRIFLUOROMETHYL)-1H-QUINOLIN-2-ONE; 2(1H)-Quinolinone, 6-amino-4-(trifluoromethyl)- |
IUPAC Name: | 6-amino-4-(trifluoromethyl)-1H-quinolin-2-one |
Molecular Weight: | 228.17 |
Molecular Formula: | C10H7F3N2O |
Canonical SMILES: | C1=CC2=C(C=C1N)C(=CC(=O)N2)C(F)(F)F |
InChI: | InChI=1S/C10H7F3N2O/c11-10(12,13)7-4-9(16)15-8-2-1-5(14)3-6(7)8/h1-4H,14H2,(H,15,16) |
InChI Key: | LMXZMEMPGRLDIG-UHFFFAOYSA-N |
Complexity: | 337 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.05104734 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.05104734 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 55.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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