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Home > Imidazoles > 415913-06-3
415913-06-3 | 1H-Imidazole-4-sulfonamide,1,2-dimethyl-(9CI)
CAS No: 415913-06-3 Catalog No: AG00CX9O MDL No:MFCD02091383
Product Description
Catalog Number:
AG00CX9O
Chemical Name:
1H-Imidazole-4-sulfonamide,1,2-dimethyl-(9CI)
CAS Number:
415913-06-3
Molecular Formula:
C5H9N3O2S
Molecular Weight:
175.2089
MDL Number:
MFCD02091383
IUPAC Name:
1,2-dimethylimidazole-4-sulfonamide
InChI:
InChI=1S/C5H9N3O2S/c1-4-7-5(3-8(4)2)11(6,9)10/h3H,1-2H3,(H2,6,9,10)
InChI Key:
IBPSPEHRHLEXKB-UHFFFAOYSA-N
SMILES:
Cn1cc(nc1C)S(=O)(=O)N
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.042g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.206g/mol
Monoisotopic Mass:
175.042g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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