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Home > Fluorides > 1443302-95-1
1443302-95-1 | 2'-n-Butoxy-2,2,2,5'-tetrafluoroacetophenone
CAS No: 1443302-95-1 Catalog No: AG01FAOA MDL No:
Product Description
Catalog Number:
AG01FAOA
Chemical Name:
2'-n-Butoxy-2,2,2,5'-tetrafluoroacetophenone
CAS Number:
1443302-95-1
Molecular Formula:
C12H12F4O2
Molecular Weight:
264.2161
IUPAC Name:
1-(2-butoxy-5-fluorophenyl)-2,2,2-trifluoroethanone
InChI:
InChI=1S/C12H12F4O2/c1-2-3-6-18-10-5-4-8(13)7-9(10)11(17)12(14,15)16/h4-5,7H,2-3,6H2,1H3
InChI Key:
RTIWOQSOPGRDCT-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1C(=O)C(F)(F)F)F
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.077g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.22g/mol
Monoisotopic Mass:
264.077g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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