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Structure

1,3-Dithiole-4,5-dicarbonitrile,2-oxo-

CAS
934-31-6
Catalog Number
ACM934316
Category
Other Products
Molecular Weight
168.1963
Molecular Formula
C5N2OS2

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What is the molecular formula of 1,3-Dithiole-4,5-dicarbonitrile, 2-oxo according to the reference?

The molecular formula is C5N2OS2.

When was 1,3-Dithiole-4,5-dicarbonitrile, 2-oxo created according to the reference?

It was created on March 27, 2005.

What is the IUPAC name of 1,3-Dithiole-4,5-dicarbonitrile, 2-oxo according to the reference?

The IUPAC name is 2-oxo-1,3-dithiole-4,5-dicarbonitrile.

What is the InChIKey of 1,3-Dithiole-4,5-dicarbonitrile, 2-oxo according to the reference?

The InChIKey is BPDMXHRQYNWQSI-UHFFFAOYSA-N.

How many hydrogen bond acceptors does 1,3-Dithiole-4,5-dicarbonitrile, 2-oxo have according to the reference?

It has 5 hydrogen bond acceptors.

What is the topological polar surface area of 1,3-Dithiole-4,5-dicarbonitrile, 2-oxo according to the reference?

The topological polar surface area is 115 Å2.

How many heavy atoms are present in 1,3-Dithiole-4,5-dicarbonitrile, 2-oxo according to the reference?

There are 10 heavy atoms.

Is 1,3-Dithiole-4,5-dicarbonitrile, 2-oxo a canonicalized compound according to the reference?

Yes, it is a canonicalized compound.

What is the molecular weight of 1,3-Dithiole-4,5-dicarbonitrile, 2-oxo according to the reference?

The molecular weight is 168.2 g/mol.

How many rotatable bond counts does 1,3-Dithiole-4,5-dicarbonitrile, 2-oxo have according to the reference?

It has 0 rotatable bond counts.

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