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Home > Fluorides > 749256-84-6
749256-84-6 | 4-Methyl-6-(trifluoromethyl)pyridin-2(1H)-one
CAS No: 749256-84-6 Catalog No: AG0057ZT MDL No:MFCD07777187
Product Description
Catalog Number:
AG0057ZT
Chemical Name:
4-Methyl-6-(trifluoromethyl)pyridin-2(1H)-one
CAS Number:
749256-84-6
Molecular Formula:
C7H6F3NO
Molecular Weight:
177.1238
MDL Number:
MFCD07777187
IUPAC Name:
4-methyl-6-(trifluoromethyl)-1H-pyridin-2-one
InChI:
InChI=1S/C7H6F3NO/c1-4-2-5(7(8,9)10)11-6(12)3-4/h2-3H,1H3,(H,11,12)
InChI Key:
FIKJHRDIKOQSFG-UHFFFAOYSA-N
SMILES:
FC(c1cc(C)cc(=O)[nH]1)(F)F
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.04g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.126g/mol
Monoisotopic Mass:
177.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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