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Home > Fluorides > 1443311-08-7
1443311-08-7 | 3'-Fluoro-5'-(trifluoromethyl)butyrophenone
CAS No: 1443311-08-7 Catalog No: AG01FAZL MDL No:
Product Description
Catalog Number:
AG01FAZL
Chemical Name:
3'-Fluoro-5'-(trifluoromethyl)butyrophenone
CAS Number:
1443311-08-7
Molecular Formula:
C11H10F4O
Molecular Weight:
234.1901
IUPAC Name:
1-[3-fluoro-5-(trifluoromethyl)phenyl]butan-1-one
InChI:
InChI=1S/C11H10F4O/c1-2-3-10(16)7-4-8(11(13,14)15)6-9(12)5-7/h4-6H,2-3H2,1H3
InChI Key:
STDRNDMGNKHQEK-UHFFFAOYSA-N
SMILES:
CCCC(=O)c1cc(F)cc(c1)C(F)(F)F
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.067g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.194g/mol
Monoisotopic Mass:
234.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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