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Structure

1-(5-Benzothiazolyl)ethanone

CAS
90347-90-3
Catalog Number
ACM90347903
Category
Other Products
Molecular Weight
177.22
Molecular Formula
C9H7NOS

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What is the molecular formula of 1-(5-Benzothiazolyl)ethanone?

The molecular formula of 1-(5-Benzothiazolyl)ethanone is C9H7NOS.

What is the molecular weight of 1-(5-Benzothiazolyl)ethanone?

The molecular weight of 1-(5-Benzothiazolyl)ethanone is 177.22 g/mol.

When was 1-(5-Benzothiazolyl)ethanone created in PubChem?

1-(5-Benzothiazolyl)ethanone was created in PubChem on October 25, 2006.

What is the IUPAC name of 1-(5-Benzothiazolyl)ethanone?

The IUPAC name of 1-(5-Benzothiazolyl)ethanone is 1-(1,3-benzothiazol-5-yl)ethanone.

What is the InChIKey of 1-(5-Benzothiazolyl)ethanone?

The InChIKey of 1-(5-Benzothiazolyl)ethanone is FCKINXPLWQMSSB-UHFFFAOYSA-N.

What is the Canonical SMILES representation of 1-(5-Benzothiazolyl)ethanone?

The Canonical SMILES representation of 1-(5-Benzothiazolyl)ethanone is CC(=O)C1=CC2=C(C=C1)SC=N2.

What is the CAS number of 1-(5-Benzothiazolyl)ethanone?

The CAS number of 1-(5-Benzothiazolyl)ethanone is 90347-90-3.

What is the XLogP3 value of 1-(5-Benzothiazolyl)ethanone?

The XLogP3 value of 1-(5-Benzothiazolyl)ethanone is 1.7.

How many hydrogen bond acceptors does 1-(5-Benzothiazolyl)ethanone have?

1-(5-Benzothiazolyl)ethanone has 3 hydrogen bond acceptors.

Is 1-(5-Benzothiazolyl)ethanone a canonicalized compound?

Yes, 1-(5-Benzothiazolyl)ethanone is a canonicalized compound in PubChem.

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