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Structure

Chembrdg-bb 4010478

CAS
925580-76-3
Catalog Number
ACM925580763
Category
Other Products
Molecular Formula
C11H9ClN2O

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Specification

Synonyms
CHEMBRDG-BB 4010478;1-[1-(4-Chlorophenyl)-1H-pyrazol-4-yl]ethanone;Albb-003682
What is the molecular formula of Chembrdg-bb 4010478?

The molecular formula of Chembrdg-bb 4010478 is C11H9ClN2O.

What is the molecular weight of Chembrdg-bb 4010478?

The molecular weight of Chembrdg-bb 4010478 is 220.65 g/mol.

When was Chembrdg-bb 4010478 created and last modified?

Chembrdg-bb 4010478 was created on July 31, 2007, and last modified on December 30, 2023.

What is the IUPAC name of Chembrdg-bb 4010478?

The IUPAC name of Chembrdg-bb 4010478 is 1-[1-(4-chlorophenyl)pyrazol-4-yl]ethanone.

What is the Canonical SMILES of Chembrdg-bb 4010478?

The Canonical SMILES of Chembrdg-bb 4010478 is CC(=O)C1=CN(N=C1)C2=CC=C(C=C2)Cl.

What is the InChIKey of Chembrdg-bb 4010478?

The InChIKey of Chembrdg-bb 4010478 is IUTPSVNWIWQIDX-UHFFFAOYSA-N.

What is the XLogP3-AA value of Chembrdg-bb 4010478?

The XLogP3-AA value of Chembrdg-bb 4010478 is 2.2.

How many hydrogen bond acceptor count does Chembrdg-bb 4010478 have?

Chembrdg-bb 4010478 has 2 hydrogen bond acceptor counts.

What is the topological polar surface area of Chembrdg-bb 4010478?

The topological polar surface area of Chembrdg-bb 4010478 is 34.9 Ų.

Is Chembrdg-bb 4010478 a canonicalized compound?

Yes, Chembrdg-bb 4010478 is a canonicalized compound according to PubChem.

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