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108966-49-0 | 4-[(2-HYDROXYETHYL)SULFONYL]BENZENESULFONAMIDE
CAS No: 108966-49-0 Catalog No: AG0082XN MDL No:
Product Description
Catalog Number:
AG0082XN
Chemical Name:
4-[(2-HYDROXYETHYL)SULFONYL]BENZENESULFONAMIDE
CAS Number:
108966-49-0
Molecular Formula:
C8H11NO5S2
Molecular Weight:
265.3066
IUPAC Name:
4-(2-hydroxyethylsulfonyl)benzenesulfonamide
InChI:
InChI=1S/C8H11NO5S2/c9-16(13,14)8-3-1-7(2-4-8)15(11,12)6-5-10/h1-4,10H,5-6H2,(H2,9,13,14)
InChI Key:
UPDXBCKJUQPWOW-UHFFFAOYSA-N
SMILES:
OCCS(=O)(=O)c1ccc(cc1)S(=O)(=O)N
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.008g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
265.298g/mol
Monoisotopic Mass:
265.008g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
131A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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