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Home > Fluorides > 1187168-61-1
1187168-61-1 | 4-Methyl-3-(3-trifluoromethylbenzoyl)pyridine
CAS No: 1187168-61-1 Catalog No: AG01FA8T MDL No:
Product Description
Catalog Number:
AG01FA8T
Chemical Name:
4-Methyl-3-(3-trifluoromethylbenzoyl)pyridine
CAS Number:
1187168-61-1
Molecular Formula:
C14H10F3NO
Molecular Weight:
265.2305
IUPAC Name:
(4-methylpyridin-3-yl)-[3-(trifluoromethyl)phenyl]methanone
InChI:
InChI=1S/C14H10F3NO/c1-9-5-6-18-8-12(9)13(19)10-3-2-4-11(7-10)14(15,16)17/h2-8H,1H3
InChI Key:
JPRTVLFSGZNGIM-UHFFFAOYSA-N
SMILES:
Cc1ccncc1C(=O)c1cccc(c1)C(F)(F)F
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.071g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.235g/mol
Monoisotopic Mass:
265.071g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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