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Home > Fluorides > 1443355-71-2
1443355-71-2 | 3',5'-Difluoro-2'-iso-pentoxypropiophenone
CAS No: 1443355-71-2 Catalog No: AG01FBDA MDL No:
Product Description
Catalog Number:
AG01FBDA
Chemical Name:
3',5'-Difluoro-2'-iso-pentoxypropiophenone
CAS Number:
1443355-71-2
Molecular Formula:
C14H18F2O2
Molecular Weight:
256.2883
IUPAC Name:
1-[3,5-difluoro-2-(3-methylbutoxy)phenyl]propan-1-one
InChI:
InChI=1S/C14H18F2O2/c1-4-13(17)11-7-10(15)8-12(16)14(11)18-6-5-9(2)3/h7-9H,4-6H2,1-3H3
InChI Key:
PWAYJLDVIZJEKC-UHFFFAOYSA-N
SMILES:
CCC(=O)c1cc(F)cc(c1OCCC(C)C)F
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.127g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.293g/mol
Monoisotopic Mass:
256.127g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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