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1443329-19-8 | 3'-n-Butoxy-4'-fluoropropiophenone
CAS No: 1443329-19-8 Catalog No: AG01FE7P MDL No:
Product Description
Catalog Number:
AG01FE7P
Chemical Name:
3'-n-Butoxy-4'-fluoropropiophenone
CAS Number:
1443329-19-8
Molecular Formula:
C13H17FO2
Molecular Weight:
224.2713
IUPAC Name:
1-(3-butoxy-4-fluorophenyl)propan-1-one
InChI:
InChI=1S/C13H17FO2/c1-3-5-8-16-13-9-10(12(15)4-2)6-7-11(13)14/h6-7,9H,3-5,8H2,1-2H3
InChI Key:
WXVFLQAFXRVBIW-UHFFFAOYSA-N
SMILES:
CCCCOc1cc(ccc1F)C(=O)CC
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.121g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.275g/mol
Monoisotopic Mass:
224.121g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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