1,3-Dibenzylbenzimidazol-3-ium

Base Information

• Chemical Name: 1,3-Dibenzylbenzimidazol-3-ium
• CAS No.: 4439-12-7
• Molecular Formula: C6H14 N4 O6
• Molecular Weight: 299.3884
• DSSTox Substance ID: DTXSID00361668
• Nikkaji Number: J723.392B
• Wikidata: Q82144101
• ChEMBL ID: CHEMBL1617067
• Mol file: 4439-12-7.mol

Synonyms:MLS001201576;4439-12-7;SMR000640974;1,3-dibenzylbenzimidazol-3-ium;SCHEMBL2218265;CHEMBL1617067;BDBM89169;cid_2933784;DTXSID00361668;1,3-dibenzyl-1H-benzimidazol-3-ium;1,3-bis(phenylmethyl)benzimidazol-3-ium;chloride

Chemical Property of 1,3-Dibenzylbenzimidazol-3-ium

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 8.81000
• Density: g/cm³
• LogP: 4.02540
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 4
• Exact Mass: 299.154823615
• Heavy Atom Count: 23
• Complexity: 323

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CN2C=[N+](C3=CC=CC=C32)CC4=CC=CC=C4