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Home > Sulfanilamide > 89392-04-1
89392-04-1 | Benzenesulfonamide, 2-(3-hydroxy-3-methyl-1-butynyl)-
CAS No: 89392-04-1 Catalog No: AG003WB3 MDL No:
Product Description
Catalog Number:
AG003WB3
Chemical Name:
Benzenesulfonamide, 2-(3-hydroxy-3-methyl-1-butynyl)-
CAS Number:
89392-04-1
Molecular Formula:
C11H13NO3S
Molecular Weight:
239.2908
IUPAC Name:
2-(3-hydroxy-3-methylbut-1-ynyl)benzenesulfonamide
InChI:
InChI=1S/C11H13NO3S/c1-11(2,13)8-7-9-5-3-4-6-10(9)16(12,14)15/h3-6,13H,1-2H3,(H2,12,14,15)
InChI Key:
DTGVXNHNQJXLDH-UHFFFAOYSA-N
SMILES:
CC(C#Cc1ccccc1S(=O)(=O)N)(O)C
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.062g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.289g/mol
Monoisotopic Mass:
239.062g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
88.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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