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Structure

1H-Pyrazole-1-carboxylic acid,2,3-dihydro-5-methyl-3-oxo-,methyl ester

CAS
915396-45-1
Catalog Number
ACM915396451
Category
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What is the molecular formula of 1H-Pyrazole-1-carboxylic acid,2,3-dihydro-5-methyl-3-oxo-,methyl ester?

The molecular formula is C6H8N2O3.

What is the PubChem CID for 1H-Pyrazole-1-carboxylic acid,2,3-dihydro-5-methyl-3-oxo-,methyl ester?

The PubChem CID is 45121218.

What is the IUPAC Name of the compound?

The IUPAC Name is methyl 3-methyl-5-oxo-1H-pyrazole-2-carboxylate.

What is the InChIKey of the compound?

The InChIKey is MJHMNOXDQAIXBV-UHFFFAOYSA-N.

What is the CAS number of 1H-Pyrazole-1-carboxylic acid,2,3-dihydro-5-methyl-3-oxo-,methyl ester?

The CAS number is 915396-45-1.

What is the molecular weight of the compound?

The molecular weight is 156.14 g/mol.

How many hydrogen bond donor counts does the compound have?

The compound has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does the compound have?

The compound has 3 hydrogen bond acceptor counts.

What is the topological polar surface area of the compound?

The topological polar surface area is 58.6Ų.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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