3-(2-isopropyl-1H-imidazol-1-yl)propanoic acid

Base Information

• Chemical Name: 3-(2-isopropyl-1H-imidazol-1-yl)propanoic acid
• CAS No.: 462068-54-8
• Molecular Formula: C9H14N2O2
• Molecular Weight: 182.22
• Hs Code.: 2933290090
• European Community (EC) Number: 675-243-4
• DSSTox Substance ID: DTXSID60353660
• Wikidata: Q82131369
• ChEMBL ID: CHEMBL1620410
• Mol file: 462068-54-8.mol

Synonyms:462068-54-8;3-(2-isopropyl-1H-imidazol-1-yl)propanoic acid;3-(2-Isopropyl-imidazol-1-yl)-propionic acid;3-(2-propan-2-ylimidazol-1-yl)propanoic acid;3-[2-(propan-2-yl)-1H-imidazol-1-yl]propanoic acid;2-(1-METHYLETHYL)-1H-IMIDAZOLE-1-PROPANOIC ACID;ChemDiv3_003513;3-(2-Isopropyl-imidazol-1-yl)propionic acid;1H-imidazole-1-propanoic acid, 2-(1-methylethyl)-;F0918-2549;SCHEMBL2627813;CHEMBL1620410;DTXSID60353660;HMS1482P15;BBL034855;MFCD02737576;STL423522;AKOS000248996;IDI1_021423;LS-09136;3-(2-isopropylimidazol-1-yl)propanoic acid;CS-0273883;EU-0045291;FT-0644703;3-(2-Isopropyl-imidazol-1-yl)-propionicacid;EC-000.1988;3-(2-isopropyl-1H-imidazol-1-yl)propanoicacid;EN300-264764;A912636;SR-01000496172;SR-01000496172-1;3-(2-isopropyl-imidazol-1-yl)-propionic acid, AldrichCPR

Chemical Property of 3-(2-isopropyl-1H-imidazol-1-yl)propanoic acid

Chemical Property:

• Vapor Pressure: 4.8E-06mmHg at 25°C
• Refractive Index: 1.546
• Boiling Point: 367.4 °C at 760 mmHg
• Flash Point: 176 °C
• PSA: 55.12000
• Density: 1.15 g/cm³
• LogP: 1.48120
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 182.105527694
• Heavy Atom Count: 13
• Complexity: 183

Purity/Quality:

98%min ^*data from raw suppliers

3-(2-isopropyl-1H-imidazol-1-yl)propanoicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,T
• Statements: 25
• Safety Statements: 45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1=NC=CN1CCC(=O)O