2-Butyn-1-amine, 4-((1-(4-(dimethylamino)-2-butynyl)-5-nitro-1H-benzimidazol-2-yl)thio)-N,N-dimethyl-

Base Information

• Chemical Name: 2-Butyn-1-amine, 4-((1-(4-(dimethylamino)-2-butynyl)-5-nitro-1H-benzimidazol-2-yl)thio)-N,N-dimethyl-
• CAS No.: 112094-01-6
• Molecular Formula: C19H23 N5 O2 S
• Molecular Weight: 385.4832
• DSSTox Substance ID: DTXSID40149886
• Wikidata: Q83015767
• Mol file: 112094-01-6.mol

Synonyms:112094-01-6;2-Butyn-1-amine, 4-((1-(4-(dimethylamino)-2-butynyl)-5-nitro-1H-benzimidazol-2-yl)thio)-N,N-dimethyl-;DTXSID40149886;LS-47463

Chemical Property of 2-Butyn-1-amine, 4-((1-(4-(dimethylamino)-2-butynyl)-5-nitro-1H-benzimidazol-2-yl)thio)-N,N-dimethyl-

Chemical Property:

• Vapor Pressure: 1.97E-12mmHg at 25°C
• Boiling Point: 556.7°Cat760mmHg
• Flash Point: 290.5°C
• Density: 1.15g/cm³
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 385.15724617
• Heavy Atom Count: 27
• Complexity: 636

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CC#CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1SCC#CCN(C)C