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Home > Fluorides > 1256467-04-5
1256467-04-5 | 4'-n-Propoxy-2,2,2-trifluoroacetophenone
CAS No: 1256467-04-5 Catalog No: AG01FBXJ MDL No:
Product Description
Catalog Number:
AG01FBXJ
Chemical Name:
4'-n-Propoxy-2,2,2-trifluoroacetophenone
CAS Number:
1256467-04-5
Molecular Formula:
C11H11F3O2
Molecular Weight:
232.1990
IUPAC Name:
2,2,2-trifluoro-1-(4-propoxyphenyl)ethanone
InChI:
InChI=1S/C11H11F3O2/c1-2-7-16-9-5-3-8(4-6-9)10(15)11(12,13)14/h3-6H,2,7H2,1H3
InChI Key:
DBGDCGHMQBHMAZ-UHFFFAOYSA-N
SMILES:
CCCOc1ccc(cc1)C(=O)C(F)(F)F
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.071g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.202g/mol
Monoisotopic Mass:
232.071g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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