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116247-30-4

116247-30-4 | 3-Quinolinecarboxylic acid, 4-hydroxy-7-(trifluoromethyl)-, hydrazide

CAS No: 116247-30-4 Catalog No: AG000C1C MDL No:

Product Description

Catalog Number:
AG000C1C
Chemical Name:
3-Quinolinecarboxylic acid, 4-hydroxy-7-(trifluoromethyl)-, hydrazide
CAS Number:
116247-30-4
Molecular Formula:
C11H8F3N3O2
Molecular Weight:
271.1953
IUPAC Name:
4-oxo-7-(trifluoromethyl)-1H-quinoline-3-carbohydrazide
InChI:
InChI=1S/C11H8F3N3O2/c12-11(13,14)5-1-2-6-8(3-5)16-4-7(9(6)18)10(19)17-15/h1-4H,15H2,(H,16,18)(H,17,19)
InChI Key:
TXPJWLXYQONJDC-UHFFFAOYSA-N
SMILES:
NNC(=O)c1cnc2c(c1O)ccc(c2)C(F)(F)F

Properties

Complexity:
433  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.057g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
271.199g/mol
Monoisotopic Mass:
271.057g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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