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Home > Fluorides > 126918-14-7
126918-14-7 | 1-Propanone, 1-(2,4-difluorophenyl)-2-hydroxy-, (2S)-
CAS No: 126918-14-7 Catalog No: AG000TGX MDL No:
Product Description
Catalog Number:
AG000TGX
Chemical Name:
1-Propanone, 1-(2,4-difluorophenyl)-2-hydroxy-, (2S)-
CAS Number:
126918-14-7
Molecular Formula:
C9H8F2O2
Molecular Weight:
186.1554
IUPAC Name:
(2S)-1-(2,4-difluorophenyl)-2-hydroxypropan-1-one
InChI:
InChI=1S/C9H8F2O2/c1-5(12)9(13)7-3-2-6(10)4-8(7)11/h2-5,12H,1H3/t5-/m0/s1
InChI Key:
REHMWFXPLWURSF-YFKPBYRVSA-N
SMILES:
Fc1ccc(c(c1)F)C(=O)[C@@H](O)C
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
186.049g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.158g/mol
Monoisotopic Mass:
186.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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