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Home > Sulfanilamide > 108966-53-6
108966-53-6 | 4-[(3-HYDROXY-3-METHYLBUTYL)THIO]BENZENESULFONAMIDE
CAS No: 108966-53-6 Catalog No: AG0082XM MDL No:
Product Description
Catalog Number:
AG0082XM
Chemical Name:
4-[(3-HYDROXY-3-METHYLBUTYL)THIO]BENZENESULFONAMIDE
CAS Number:
108966-53-6
Molecular Formula:
C11H17NO3S2
Molecular Weight:
275.3876
IUPAC Name:
4-(3-hydroxy-3-methylbutyl)sulfanylbenzenesulfonamide
InChI:
InChI=1S/C11H17NO3S2/c1-11(2,13)7-8-16-9-3-5-10(6-4-9)17(12,14)15/h3-6,13H,7-8H2,1-2H3,(H2,12,14,15)
InChI Key:
QDBGFWZGJHWBLM-UHFFFAOYSA-N
SMILES:
CC(CCSc1ccc(cc1)S(=O)(=O)N)(O)C
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.065g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
275.381g/mol
Monoisotopic Mass:
275.065g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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