2-(1-methyl-1H-imidazol-5-yl)acetic acid - CAS 4200-48-0
Catalog: |
BB025009 |
Product Name: |
2-(1-methyl-1H-imidazol-5-yl)acetic acid |
CAS: |
4200-48-0 |
Synonyms: |
2-(3-methyl-4-imidazolyl)acetic acid; 2-(3-methylimidazol-4-yl)acetic acid |
IUPAC Name: | 2-(3-methylimidazol-4-yl)acetic acid |
Description: | 2-(1-methyl-1H-imidazol-5-yl)acetic acid (CAS# 4200-48-0) is a useful research chemical compound. |
Molecular Weight: | 140.142 |
Molecular Formula: | C6H8N2O2 |
Canonical SMILES: | CN1C=NC=C1CC(=O)O |
InChI: | InChI=1S/C6H8N2O2/c1-8-4-7-3-5(8)2-6(9)10/h3-4H,2H2,1H3,(H,9,10) |
InChI Key: | UJCGYTCAMOHYCG-UHFFFAOYSA-N |
Boiling Point: | 384.4 °C at 760 mmHg |
Density: | 1.27 g/cm3 |
Appearance: | Solid |
LogP: | 0.04720 |
Publication Number | Title | Priority Date |
US-2020345799-A1 | Compositions and methods for improving skin health and for the treatment and prevention of diseases, disorders and conditions associated with pathogenic microbes | 20190409 |
US-11040077-B2 | Compositions and methods for improving skin health and for the treatment and prevention of diseases, disorders and conditions associated with pathogenic microbes | 20190409 |
US-2019391092-A1 | Metabolic profiling with magnetic resonance mass spectrometry (mrms) | 20180621 |
US-2021038654-A1 | Compositions for modulating gut microflora populations, enhancing drug potency and treating cancer, and methods for making and using same | 20180316 |
AU-2017257627-A1 | Corrosion inhibitor compositions and methods of using same | 20160426 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 140.058577502 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 140.058577502 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.5 |
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Imidazoles
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