71759-89-2 Purity
98%
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Specification
The molecular formula of ethyl imidazole-4-carboxylate is C6H8N2O2.
The molecular weight of ethyl imidazole-4-carboxylate is 140.14 g/mol.
The IUPAC name of ethyl imidazole-4-carboxylate is ethyl 1H-imidazole-5-carboxylate.
The InChI of ethyl imidazole-4-carboxylate is InChI=1S/C6H8N2O2/c1-2-10-6(9)5-3-7-4-8-5/h3-4H,2H2,1H3,(H,7,8).
The InChIKey of ethyl imidazole-4-carboxylate is KLWYPRNPRNPORS-UHFFFAOYSA-N.
The canonical SMILES of ethyl imidazole-4-carboxylate is CCOC(=O)C1=CN=CN1.
The CAS number of ethyl imidazole-4-carboxylate is 23785-21-9.
Ethyl imidazole-4-carboxylate has 1 hydrogen bond donor count.
Ethyl imidazole-4-carboxylate has 3 hydrogen bond acceptor counts.
The topological polar surface area of ethyl imidazole-4-carboxylate is 55.2.