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Home > Fluorides > 1094748-74-9
1094748-74-9 | 3'-Fluoro-6'-methoxy-2-methylpropiophenone
CAS No: 1094748-74-9 Catalog No: AG01FB5C MDL No:
Product Description
Catalog Number:
AG01FB5C
Chemical Name:
3'-Fluoro-6'-methoxy-2-methylpropiophenone
CAS Number:
1094748-74-9
Molecular Formula:
C11H13FO2
Molecular Weight:
196.2181
IUPAC Name:
1-(5-fluoro-2-methoxyphenyl)-2-methylpropan-1-one
InChI:
InChI=1S/C11H13FO2/c1-7(2)11(13)9-6-8(12)4-5-10(9)14-3/h4-7H,1-3H3
InChI Key:
DSSMBWGEONAIPN-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C(=O)C(C)C)F
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.221g/mol
Monoisotopic Mass:
196.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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