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Home > Fluorides > 261763-30-8
261763-30-8 | Ethanone, 1-(2,3-difluoro-4-methylphenyl)-
CAS No: 261763-30-8 Catalog No: AG002S2K MDL No:MFCD01631650
Product Description
Catalog Number:
AG002S2K
Chemical Name:
Ethanone, 1-(2,3-difluoro-4-methylphenyl)-
CAS Number:
261763-30-8
Molecular Formula:
C9H8F2O
Molecular Weight:
170.1560
MDL Number:
MFCD01631650
IUPAC Name:
1-(2,3-difluoro-4-methylphenyl)ethanone
InChI:
InChI=1S/C9H8F2O/c1-5-3-4-7(6(2)12)9(11)8(5)10/h3-4H,1-2H3
InChI Key:
PIYDLEQMYRPHPO-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc(c(c1F)F)C
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.054g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.159g/mol
Monoisotopic Mass:
170.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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