Methyl 4-imidazolecarboxylate

CAS
17325-26-7
Catalog Number
ACM17325267
Category
Imidazoles
Molecular Weight
126.11
Molecular Formula
C5H6N2O2

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Specification

Boiling Point
318.2ºC at 760mmHg
Melting Point
154-156 °C
Density
1.275 g/cm³
Appearance
White crystalline powder
What is the molecular formula of Methyl 4-imidazolecarboxylate?

The molecular formula is C5H6N2O2.

What is the molecular weight of Methyl 4-imidazolecarboxylate?

The molecular weight is 126.11 g/mol.

What is the IUPAC name of Methyl 4-imidazolecarboxylate?

The IUPAC name is methyl 1H-imidazole-5-carboxylate.

What is the InChI of Methyl 4-imidazolecarboxylate?

The InChI is InChI=1S/C5H6N2O2/c1-9-5(8)4-2-6-3-7-4/h2-3H,1H3,(H,6,7).

What is the InChIKey of Methyl 4-imidazolecarboxylate?

The InChIKey is DVLGIQNHKLWSRU-UHFFFAOYSA-N.

What is the canonical SMILES of Methyl 4-imidazolecarboxylate?

The canonical SMILES is COC(=O)C1=CN=CN1.

What is the CAS number of Methyl 4-imidazolecarboxylate?

The CAS number is 17325-26-7.

What is the European Community (EC) number of Methyl 4-imidazolecarboxylate?

The European Community (EC) number is 626-673-6.

What is the ChEMBL ID of Methyl 4-imidazolecarboxylate?

The ChEMBL ID is CHEMBL1866040.

Is Methyl 4-imidazolecarboxylate a canonicalized compound?

Yes, Methyl 4-imidazolecarboxylate is canonicalized.

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