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Home > Fluorides > 845617-59-6
845617-59-6 | 1,2-Difluoro-4-ethylsulfonylbenzene
CAS No: 845617-59-6 Catalog No: AG01EXPH MDL No:
Product Description
Catalog Number:
AG01EXPH
Chemical Name:
1,2-Difluoro-4-ethylsulfonylbenzene
CAS Number:
845617-59-6
Molecular Formula:
C8H8F2O2S
Molecular Weight:
206.2097
IUPAC Name:
4-ethylsulfonyl-1,2-difluorobenzene
InChI:
InChI=1S/C8H8F2O2S/c1-2-13(11,12)6-3-4-7(9)8(10)5-6/h3-5H,2H2,1H3
InChI Key:
YSKPJNBCDJOHGJ-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)c1ccc(c(c1)F)F
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.021g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.207g/mol
Monoisotopic Mass:
206.021g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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