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Home > Sulfanilamide > 87474-21-3
87474-21-3 | 1,4-Benzodithiin-5-sulfonamide, 2,3-dihydro-
CAS No: 87474-21-3 Catalog No: AG004FNJ MDL No:
Product Description
Catalog Number:
AG004FNJ
Chemical Name:
1,4-Benzodithiin-5-sulfonamide, 2,3-dihydro-
CAS Number:
87474-21-3
Molecular Formula:
C8H9NO2S3
Molecular Weight:
247.3576
IUPAC Name:
2,3-dihydro-1,4-benzodithiine-5-sulfonamide
InChI:
InChI=1S/C8H9NO2S3/c9-14(10,11)7-3-1-2-6-8(7)13-5-4-12-6/h1-3H,4-5H2,(H2,9,10,11)
InChI Key:
SZZJNLLXLFFMBR-UHFFFAOYSA-N
SMILES:
NS(=O)(=O)c1cccc2c1SCCS2
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.98g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.345g/mol
Monoisotopic Mass:
246.98g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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