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Home > Fluorides > 116332-55-9
116332-55-9 | 3-(1,3-Dioxolan-2-yl)-4'-fluoropropiophenone
CAS No: 116332-55-9 Catalog No: AG01FAK1 MDL No:
Product Description
Catalog Number:
AG01FAK1
Chemical Name:
3-(1,3-Dioxolan-2-yl)-4'-fluoropropiophenone
CAS Number:
116332-55-9
Molecular Formula:
C12H13FO3
Molecular Weight:
224.2282
IUPAC Name:
3-(1,3-dioxolan-2-yl)-1-(4-fluorophenyl)propan-1-one
InChI:
InChI=1S/C12H13FO3/c13-10-3-1-9(2-4-10)11(14)5-6-12-15-7-8-16-12/h1-4,12H,5-8H2
InChI Key:
MEOUVTIIMKHILV-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)F)CCC1OCCO1
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.085g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.231g/mol
Monoisotopic Mass:
224.085g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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