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Home > Sulfanilamide > 57476-34-3
57476-34-3 | 2-METHYL-1H-1,3-BENZODIAZOLE-5-SULFONAMIDE
CAS No: 57476-34-3 Catalog No: AG01B2ST MDL No:MFCD01790988
Product Description
Catalog Number:
AG01B2ST
Chemical Name:
2-METHYL-1H-1,3-BENZODIAZOLE-5-SULFONAMIDE
CAS Number:
57476-34-3
Molecular Formula:
C8H9N3O2S
Molecular Weight:
211.2410
MDL Number:
MFCD01790988
IUPAC Name:
2-methyl-3H-benzimidazole-5-sulfonamide
InChI:
InChI=1S/C8H9N3O2S/c1-5-10-7-3-2-6(14(9,12)13)4-8(7)11-5/h2-4H,1H3,(H,10,11)(H2,9,12,13)
InChI Key:
RCMNETJGBWEEEK-UHFFFAOYSA-N
SMILES:
Cc1[nH]c2c(n1)cc(cc2)S(=O)(=O)N
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.042g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
211.239g/mol
Monoisotopic Mass:
211.042g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
97.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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