Methyl 1-propylbenzoimidazole-6-carboxylate

Base Information

• Chemical Name: Methyl 1-propylbenzoimidazole-6-carboxylate
• CAS No.: 1199773-30-2
• Molecular Formula: C12H14N2O2
• Molecular Weight: 218.25176
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID20682029
• Wikidata: Q82606259
• Mol file: 1199773-30-2.mol

Synonyms:1199773-30-2;METHYL 1-PROPYLBENZOIMIDAZOLE-6-CARBOXYLATE;Methyl 1-propyl-1H-benzo[d]imidazole-6-carboxylate;methyl 3-propylbenzimidazole-5-carboxylate;Methyl 1-propyl-1H-benzimidazole-6-carboxylate;DTXSID20682029;ZXB77330;MFCD13195707;AKOS015839611;BS-20026;CS-0212510;methyl 1-propyl-1H-1,3-benzodiazole-6-carboxylate

Chemical Property of Methyl 1-propylbenzoimidazole-6-carboxylate

Chemical Property:

• PSA: 44.12000
• LogP: 2.23290
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 218.105527694
• Heavy Atom Count: 16
• Complexity: 257

Purity/Quality:

≥95% ^*data from raw suppliers

Methyl1-Propylbenzoimidazole-6-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCN1C=NC2=C1C=C(C=C2)C(=O)OC