3-(2-methyl-1H-imidazol-1-yl)butanoic acid

Base Information

• Chemical Name: 3-(2-methyl-1H-imidazol-1-yl)butanoic acid
• CAS No.: 98009-61-1
• Molecular Formula: C8H12N2O2
• Molecular Weight: 168.19308
• Hs Code.: 2933290090
• DSSTox Substance ID: DTXSID50389231
• Mol file: 98009-61-1.mol

Synonyms:3-(2-methyl-1H-imidazol-1-yl)butanoic acid;98009-61-1;3-(2-methylimidazol-1-yl)butanoic acid;3-(2-Methyl-imidazol-1-yl)-butyric acid;TimTec1_001709;DTXSID50389231;HMS1538N15;BBL007545;MFCD00749149;STK499954;AKOS000276460;AKOS016041686;3-(2-Methylimidazol-1-yl)butyric acid;NCGC00174145-01;VS-01673;BB 0240553;CS-0313338;EU-0068226;FT-0736331;SR-01000400772;SR-01000400772-1;F0451-1740

Chemical Property of 3-(2-methyl-1H-imidazol-1-yl)butanoic acid

Chemical Property:

• PSA: 55.12000
• LogP: 1.22720
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 168.089877630
• Heavy Atom Count: 12
• Complexity: 172

Purity/Quality:

98%min ^*data from raw suppliers

3-(2-methyl-1H-imidazol-1-yl)butanoicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC=CN1C(C)CC(=O)O