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59431-14-0 | Methylthiomethyl phenyl sulfone
CAS No: 59431-14-0 Catalog No: AG003S4F MDL No:
Product Description
Catalog Number:
AG003S4F
Chemical Name:
Methylthiomethyl phenyl sulfone
CAS Number:
59431-14-0
IUPAC Name:
methylsulfanylmethylsulfonylbenzene
InChI:
InChI=1S/C8H10O2S2/c1-11-7-12(9,10)8-5-3-2-4-6-8/h2-6H,7H2,1H3
InChI Key:
XBGGZYQBIQAYII-UHFFFAOYSA-N
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.012g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.286g/mol
Monoisotopic Mass:
202.012g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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