6-(1H-Imidazol-1-yl)-6-oxohexanoic acid

Base Information

• Chemical Name: 6-(1H-Imidazol-1-yl)-6-oxohexanoic acid
• CAS No.: 60718-46-9
• Molecular Formula: C9H12 N2 O3
• Molecular Weight: 196.20318
• European Community (EC) Number: 262-389-5
• UNII: Y7CN97VX2E
• DSSTox Substance ID: DTXSID9069425
• Nikkaji Number: J268.271K
• Wikidata: Q81996304
• Mol file: 60718-46-9.mol

Synonyms:6-(1H-Imidazol-1-yl)-6-oxohexanoic acid;Adipic acid imidazole monoamide;60718-46-9;Adipic acid, imidazole monoamide;Y7CN97VX2E;EINECS 262-389-5;1H-Imidazole-1-hexanoic acid, epsilon-oxo-;UNII-Y7CN97VX2E;SCHEMBL8032072;DTXSID9069425;1H-Imidazole-1-hexanoic acid, .epsilon.-oxo-;Hexanoic acid, 6-(1H-imidazol-1-yl)-6-oxo-

Chemical Property of 6-(1H-Imidazol-1-yl)-6-oxohexanoic acid

Chemical Property:

• Vapor Pressure: 1.31E-07mmHg at 25°C
• Boiling Point: 414.3°C at 760 mmHg
• Flash Point: 204.4°C
• PSA: 72.19000
• Density: 1.25g/cm³
• LogP: 1.16830
• XLogP3: -0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 196.08479225
• Heavy Atom Count: 14
• Complexity: 218

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CN(C=N1)C(=O)CCCCC(=O)O