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105955-46-2 | Methanesulfonamide, N-(2-mercaptophenyl)-N-(methylsulfonyl)-
CAS No: 105955-46-2 Catalog No: AG007WFX MDL No:
Product Description
Catalog Number:
AG007WFX
Chemical Name:
Methanesulfonamide, N-(2-mercaptophenyl)-N-(methylsulfonyl)-
CAS Number:
105955-46-2
Molecular Formula:
C8H11NO4S3
Molecular Weight:
281.3722
IUPAC Name:
N-methylsulfonyl-N-(2-sulfanylphenyl)methanesulfonamide
InChI:
InChI=1S/C8H11NO4S3/c1-15(10,11)9(16(2,12)13)7-5-3-4-6-8(7)14/h3-6,14H,1-2H3
InChI Key:
FUJUACFJSDKJIQ-UHFFFAOYSA-N
SMILES:
Sc1ccccc1N(S(=O)(=O)C)S(=O)(=O)C
Properties
Complexity:
399
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.985g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.359g/mol
Monoisotopic Mass:
280.985g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
89.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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