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2110266-53-8 | 1-methyl-1H-imidazole-5-sulfonamide
CAS No: 2110266-53-8 Catalog No: AG01EIZ3 MDL No:
Product Description
Catalog Number:
AG01EIZ3
Chemical Name:
1-methyl-1H-imidazole-5-sulfonamide
CAS Number:
2110266-53-8
Molecular Formula:
C4H7N3O2S
Molecular Weight:
161.1823
IUPAC Name:
3-methylimidazole-4-sulfonamide
InChI:
InChI=1S/C4H7N3O2S/c1-7-3-6-2-4(7)10(5,8)9/h2-3H,1H3,(H2,5,8,9)
InChI Key:
CUCDEDAWEGQBPY-UHFFFAOYSA-N
SMILES:
Cn1cncc1S(=O)(=O)N
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.026g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.179g/mol
Monoisotopic Mass:
161.026g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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