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Home > Fluorides > 1443346-11-9
1443346-11-9 | 4',5'-Difluoro-3'-n-propoxypropiophenone
CAS No: 1443346-11-9 Catalog No: AG01FC2P MDL No:
Product Description
Catalog Number:
AG01FC2P
Chemical Name:
4',5'-Difluoro-3'-n-propoxypropiophenone
CAS Number:
1443346-11-9
Molecular Formula:
C12H14F2O2
Molecular Weight:
228.2352
IUPAC Name:
1-(3,4-difluoro-5-propoxyphenyl)propan-1-one
InChI:
InChI=1S/C12H14F2O2/c1-3-5-16-11-7-8(10(15)4-2)6-9(13)12(11)14/h6-7H,3-5H2,1-2H3
InChI Key:
ZJVPMXCRKGZGDI-UHFFFAOYSA-N
SMILES:
CCCOc1cc(cc(c1F)F)C(=O)CC
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.096g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.239g/mol
Monoisotopic Mass:
228.096g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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