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Home > Fluorides > 1261803-34-2
1261803-34-2 | 5-Quinolinol, 3-(trifluoromethyl)-
CAS No: 1261803-34-2 Catalog No: AG000S18 MDL No:MFCD18414821
Product Description
Catalog Number:
AG000S18
Chemical Name:
5-Quinolinol, 3-(trifluoromethyl)-
CAS Number:
1261803-34-2
Molecular Formula:
C10H6F3NO
Molecular Weight:
213.1559
MDL Number:
MFCD18414821
IUPAC Name:
3-(trifluoromethyl)quinolin-5-ol
InChI:
InChI=1S/C10H6F3NO/c11-10(12,13)6-4-7-8(14-5-6)2-1-3-9(7)15/h1-5,15H
InChI Key:
WITKYAAQTYOHMS-UHFFFAOYSA-N
SMILES:
Oc1cccc2c1cc(cn2)C(F)(F)F
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.04g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.159g/mol
Monoisotopic Mass:
213.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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