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Structure

Methyl 4-bromo-1-methyl-1H-pyrazole-3-carboxylate

CAS
211738-66-8
Catalog Number
ACM211738668
Category
Bromine Series

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What is the molecular formula of Methyl 4-bromo-1-methyl-1H-pyrazole-3-carboxylate?

The molecular formula is C6H7BrN2O2.

What is the molecular weight of Methyl 4-bromo-1-methyl-1H-pyrazole-3-carboxylate?

The molecular weight is 219.04 g/mol.

What is the IUPAC name of Methyl 4-bromo-1-methyl-1H-pyrazole-3-carboxylate?

The IUPAC name is methyl 4-bromo-1-methylpyrazole-3-carboxylate.

What is the InChI of Methyl 4-bromo-1-methyl-1H-pyrazole-3-carboxylate?

The InChI is InChI=1S/C6H7BrN2O2/c1-9-3-4(7)5(8-9)6(10)11-2/h3H,1-2H3.

What is the InChIKey of Methyl 4-bromo-1-methyl-1H-pyrazole-3-carboxylate?

The InChIKey is PFKHXPUGZRGBPX-UHFFFAOYSA-N.

What is the canonical SMILES of Methyl 4-bromo-1-methyl-1H-pyrazole-3-carboxylate?

The canonical SMILES is CN1C=C(C(=N1)C(=O)OC)Br.

What is the CAS number of Methyl 4-bromo-1-methyl-1H-pyrazole-3-carboxylate?

The CAS number is 211738-66-8.

What is the European Community (EC) number of Methyl 4-bromo-1-methyl-1H-pyrazole-3-carboxylate?

The EC number is 675-322-3.

What is the XLogP3-AA value of Methyl 4-bromo-1-methyl-1H-pyrazole-3-carboxylate?

The XLogP3-AA value is 1.1.

Is Methyl 4-bromo-1-methyl-1H-pyrazole-3-carboxylate a canonicalized compound?

Yes, it is a canonicalized compound.

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