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Structure

4-methylthiophene-3-carbonitrile

CAS
73229-39-7
Catalog Number
ACM73229397
Category
Thiophenes
Molecular Weight
123.18
Molecular Formula
C6H5NS

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Specification

Synonyms
3-Cyano-4-Methylthiophene; 4-Methyl-3-Thiophenecarbonitrile
What is the molecular formula of 4-methylthiophene-3-carbonitrile?

The molecular formula of 4-methylthiophene-3-carbonitrile is C6H5NS.

What is the molecular weight of 4-methylthiophene-3-carbonitrile?

The molecular weight of 4-methylthiophene-3-carbonitrile is 123.18 g/mol.

What is the IUPAC name of 4-methylthiophene-3-carbonitrile?

The IUPAC name of 4-methylthiophene-3-carbonitrile is 4-methylthiophene-3-carbonitrile.

What is the InChIKey of 4-methylthiophene-3-carbonitrile?

The InChIKey of 4-methylthiophene-3-carbonitrile is GJMSUOPXSZFRTE-UHFFFAOYSA-N.

What is the canonical SMILES representation of 4-methylthiophene-3-carbonitrile?

The canonical SMILES representation of 4-methylthiophene-3-carbonitrile is CC1=CSC=C1C#N.

How many hydrogen bond donor counts are there in 4-methylthiophene-3-carbonitrile?

There are 0 hydrogen bond donor counts in 4-methylthiophene-3-carbonitrile.

What is the topological polar surface area of 4-methylthiophene-3-carbonitrile?

The topological polar surface area of 4-methylthiophene-3-carbonitrile is 52 Å2.

How many heavy atoms are present in the 4-methylthiophene-3-carbonitrile molecule?

There are 8 heavy atoms present in the 4-methylthiophene-3-carbonitrile molecule.

Is the compound canonicalized in 4-methylthiophene-3-carbonitrile?

Yes, the compound is canonicalized in 4-methylthiophene-3-carbonitrile.

What is the complexity value of 4-methylthiophene-3-carbonitrile?

The complexity value of 4-methylthiophene-3-carbonitrile is 124.

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