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Home > Fluorides > 1443346-15-3
1443346-15-3 | 1-(3,4-Difluorophenyl)pentan-2-one
CAS No: 1443346-15-3 Catalog No: AG01EU45 MDL No:
Product Description
Catalog Number:
AG01EU45
Chemical Name:
1-(3,4-Difluorophenyl)pentan-2-one
CAS Number:
1443346-15-3
Molecular Formula:
C11H12F2O
Molecular Weight:
198.2092
IUPAC Name:
1-(3,4-difluorophenyl)pentan-2-one
InChI:
InChI=1S/C11H12F2O/c1-2-3-9(14)6-8-4-5-10(12)11(13)7-8/h4-5,7H,2-3,6H2,1H3
InChI Key:
REMCBMKFFIFCKV-UHFFFAOYSA-N
SMILES:
CCCC(=O)Cc1ccc(c(c1)F)F
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.086g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.213g/mol
Monoisotopic Mass:
198.086g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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