1-Methyl-1H-imidazole-2-carboxylic acid - CAS 20485-43-2
Catalog: |
BB016004 |
Product Name: |
1-Methyl-1H-imidazole-2-carboxylic acid |
CAS: |
20485-43-2 |
Synonyms: |
1H-Imidazole-2-carboxylic acid, 1-methyl-; 1-methyl-imidazole-2-carboxylic acid; N-methyl-imidazole-2-carboxylic acid; 1-Methyl-1H-2-imidazolecarboxylic acid |
IUPAC Name: | 1-methylimidazole-2-carboxylic acid |
Description: | 1-Methylimidazole-2-carboxylic Acid (CAS# 20485-43-2) is useful for solid phase synthesis of polyamides containing imidazole. |
Molecular Weight: | 126.11 |
Molecular Formula: | C5H6N2O2 |
Canonical SMILES: | CN1C=CN=C1C(=O)O |
InChI: | InChI=1S/C5H6N2O2/c1-7-3-2-6-4(7)5(8)9/h2-3H,1H3,(H,8,9) |
InChI Key: | WLDPWZQYAVZTTP-UHFFFAOYSA-N |
Boiling Point: | 339.4±25.0°C (Predicted) |
Melting Point: | 104°C (dec.) |
Purity: | ≥95% |
Density: | 1.34±0.1 g/cm3 (Predicted) |
Solubility: | Soluble in Methanol, Water |
Appearance: | Yellowish Brown Solid |
MDL: | MFCD01863421 |
LogP: | 0.11830 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112359594-A | Medical fiber material, preparation method and application thereof | 20201009 |
WO-2021188911-A1 | Cyclic sulfonamide derivatives as trap1 modulators and uses thereof | 20200320 |
CN-111187218-A | Application of 1-substituted-1H-imidazole-2-carboxylic acid compounds in preparation of metal β -lactamase inhibitor | 20200226 |
CN-111253317-A | 1-substituted-1H-imidazole-2-carboxylic acid compound | 20200226 |
WO-2021046315-A2 | Inhibitors of encephalitic alphaviruses | 20190905 |
PMID | Publication Date | Title | Journal |
21695713 | 20110901 | Cytotoxic and antimicrobial activities of Cu(II), Co(II), Pt(II) and Zn(II) Complexes with N,O-chelating heterocyclic carboxylates | Archiv der Pharmazie |
Complexity: | 126 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 126.042927438 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 126.042927438 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 55.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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