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(6-Fluoro-4-(trifluoromethyl)quinolin-2-yl)methanol

CAS No.:
1116339-63-9
Catalog Number:
AG0079EH
Molecular Formula:
C11H7F4NO
Molecular Weight:
245.1730
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Product Description
Catalog Number:
AG0079EH
Chemical Name:
(6-Fluoro-4-(trifluoromethyl)quinolin-2-yl)methanol
CAS Number:
1116339-63-9
Molecular Formula:
C11H7F4NO
Molecular Weight:
245.1730
MDL Number:
MFCD11707224
IUPAC Name:
[6-fluoro-4-(trifluoromethyl)quinolin-2-yl]methanol
InChI:
InChI=1S/C11H7F4NO/c12-6-1-2-10-8(3-6)9(11(13,14)15)4-7(5-17)16-10/h1-4,17H,5H2
InChI Key:
GTOXFQDLERZVOY-UHFFFAOYSA-N
SMILES:
OCc1nc2ccc(cc2c(c1)C(F)(F)F)F
Properties
Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.046g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
245.177g/mol
Monoisotopic Mass:
245.046g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties