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Home > Fluorides > 1443348-46-6
1443348-46-6 | 4'-n-Butoxy-2'-methyl-2,2,2-trifluoroacetophenone
CAS No: 1443348-46-6 Catalog No: AG01F9C9 MDL No:
Product Description
Catalog Number:
AG01F9C9
Chemical Name:
4'-n-Butoxy-2'-methyl-2,2,2-trifluoroacetophenone
CAS Number:
1443348-46-6
Molecular Formula:
C13H15F3O2
Molecular Weight:
260.2522
IUPAC Name:
1-(4-butoxy-2-methylphenyl)-2,2,2-trifluoroethanone
InChI:
InChI=1S/C13H15F3O2/c1-3-4-7-18-10-5-6-11(9(2)8-10)12(17)13(14,15)16/h5-6,8H,3-4,7H2,1-2H3
InChI Key:
RXUHPXYDPOXFPX-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(c(c1)C)C(=O)C(F)(F)F
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.102g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.256g/mol
Monoisotopic Mass:
260.102g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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