1-Methylimidazole-4-sulfonamide

Base Information

• Chemical Name: 1-Methylimidazole-4-sulfonamide
• CAS No.: 111124-90-4
• Molecular Formula: C4H7N3O2S
• Molecular Weight: 161.184
• Hs Code.: 2935009090
• European Community (EC) Number: 673-090-8
• DSSTox Substance ID: DTXSID10371677
• Wikidata: Q82159099
• Mol file: 111124-90-4.mol

Synonyms:1-methylimidazole-4-sulfonamide;1-methyl-1H-imidazole-4-sulfonamide;111124-90-4;1-methyl-1h-imidazole-4-sulphonamide;MixCom1_000094;Maybridge1_000050;SPR_7;SCHEMBL50543;BDBM36003;DTXSID10371677;QBJSSOBNVYDCDQ-UHFFFAOYSA-N;CCG-40808;MFCD02091382;1-methyl-1H-imidazol-4-ylsulfonamide;AKOS009157608;FS-1470;1-methyl-1H-imidazole-4-sulfonic acid amide;CS-0300722;FT-0608034;EN300-89520;1-methyl-1H-imidazole-4-sulfonamide, AldrichCPR;A802296;J-002524;SR-01000630924-1;Z979270386;E4I

Chemical Property of 1-Methylimidazole-4-sulfonamide

Chemical Property:

• Vapor Pressure: 1.55E-08mmHg at 25°C
• Melting Point: 222 °C
• Refractive Index: 1.66
• Boiling Point: 457 °C at 760 mmHg
• PKA: 9.58±0.60(Predicted)
• Flash Point: 230.2 °C
• PSA: 86.36000
• Density: 1.61 g/cm³
• LogP: 0.84860
• XLogP3: -1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 161.02589765
• Heavy Atom Count: 10
• Complexity: 207

Purity/Quality:

98%Min ^*data from raw suppliers

1-Methylimidazole-4-sulfonamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38-36
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C=C(N=C1)S(=O)(=O)N