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Structure

5-(4-Methoxy-phenyl)-2H-pyrazole-3-carboxylic acid ethyl ester

CAS
938182-54-8
Catalog Number
ACM938182548
Category
Other Products
Molecular Weight
246.26
Molecular Formula
C13H14N2O3

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Specification

Synonyms
AKOS BBS-00004589;5-(4-METHOXY-PHENYL)-2H-PYRAZOLE-3-CARBOXYLIC ACID ETHYL ESTER;ETHYL 3-(4-METHOXYPHENYL)-1H-PYRAZOLE-5-CARBOXYLATE
What is the molecular formula of the compound?

The molecular formula of the compound is C13H14N2O3.

What is the molecular weight of the compound?

The molecular weight of the compound is 246.26 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is ethyl 3-(4-methoxyphenyl)-1H-pyrazole-5-carboxylate.

What is the InChIKey of the compound?

The InChIKey of the compound is SDGZPPOLTPVBLP-UHFFFAOYSA-N.

What is the CAS number of the compound?

The CAS number of the compound is 229015-76-3.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value of the compound is 2.4.

How many hydrogen bond donor atoms are there in the compound?

There is 1 hydrogen bond donor atom in the compound.

How many hydrogen bond acceptor atoms are there in the compound?

There are 4 hydrogen bond acceptor atoms in the compound.

How many rotatable bonds are there in the compound?

There are 5 rotatable bonds in the compound.

Is the compound a canonicalized compound?

Yes, the compound is a canonicalized compound.

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