Ethyl 1-Methylimidazole-4-carboxylate - CAS 41507-56-6
Catalog: |
BB024899 |
Product Name: |
Ethyl 1-Methylimidazole-4-carboxylate |
CAS: |
41507-56-6 |
Synonyms: |
1-methyl-4-imidazolecarboxylic acid ethyl ester; ethyl 1-methylimidazole-4-carboxylate |
IUPAC Name: | ethyl 1-methylimidazole-4-carboxylate |
Description: | Ethyl 1-Methylimidazole-4-carboxylate (CAS# 41507-56-6) is a useful research chemical. |
Molecular Weight: | 154.17 |
Molecular Formula: | C7H10N2O2 |
Canonical SMILES: | CCOC(=O)C1=CN(C=N1)C |
InChI: | InChI=1S/C7H10N2O2/c1-3-11-7(10)6-4-9(2)5-8-6/h4-5H,3H2,1-2H3 |
InChI Key: | CYPCWFKNFJRMQN-UHFFFAOYSA-N |
Boiling Point: | 294.9 °C at 760 mmHg |
Density: | 1.14 g/cm3 |
LogP: | 0.59680 |
Publication Number | Title | Priority Date |
WO-2021106230-A1 | Novel phenol compound or salt thereof | 20191129 |
WO-2020135771-A1 | Heterocyclic compound intermediate, preparation method therefor and application thereof | 20181229 |
TW-202028201-A | Process for preparing imidazole derivatives | 20181011 |
CN-112867713-A | Process for preparing imidazole derivatives | 20181011 |
KR-20210074318-A | Method for preparing imidazole derivatives | 20181011 |
Complexity: | 149 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.074227566 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.074227566 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 44.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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