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Structure

5-Methyl-2-[(2-nitrophenyl)amino]thiophene-3-carbonitrile

CAS
138564-59-7
Catalog Number
ACM138564597
Category
Other Products
Molecular Weight
259.28
Molecular Formula
C12H9N3O2S

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Specification

Synonyms
2-(2-NITROANILINE)-3-CYANO-5-METHYL THIOPHENE;2-(2-NITROANILINO)-5-METHYL-3-THIOPHENECARBONITRILE;3-CYANO-5-METHYL-2-(2-NITROANILINO)THIOPHENE;2-(2-Nitro Anilino)-5-Methyl Thiophene-3-Carbonitrile ;2-(2-NITROPHENYLAMINE)-3-CYANO-5-METHYLTHIOFURAN;5-methyl-2-((2-nitrophenyl)amino)-3-thiophenecarbonitrile;5-METHYL-2-[(2-NITROPHENYL)AMINO]THIOPHENE-3-CARBONITRILE;2-(2-NITROANILINO)-5-METHYL THIOPHENE-3-CARBONITRILE 98.0+%
Hazard Statements
N
Safety Description
22-60-61
Supplemental Hazard Statements
H319-H410
Symbol
GHS07,GHS09
What is the molecular formula of the compound with PubChem CID 395460?

The molecular formula is C12H9N3O2S.

What are some synonyms for the compound with PubChem CID 395460?

Some synonyms include 5-Methyl-2-((2-nitrophenyl)amino)thiophene-3-carbonitrile and 3-Cyano-5-methyl-2-(2-nitroanilino)thiophene.

When was the compound with PubChem CID 395460 created?

It was created in 2005.

What is the InChIKey for the compound with PubChem CID 395460?

The InChIKey is NPXUFPFFHANGDL-UHFFFAOYSA-N.

What is the Canonical SMILES for the compound with PubChem CID 395460?

The Canonical SMILES is CC1=CC(=C(S1)NC2=CC=CC=C2[N+](=O)[O-])C#N.

What is the molecular weight of the compound with PubChem CID 395460?

The molecular weight is 259.29 g/mol.

How many hydrogen bond donor counts does the compound with PubChem CID 395460 have?

It has 1 hydrogen bond donor count.

What is the topological polar surface area of the compound with PubChem CID 395460?

The topological polar surface area is 110 Ų.

How many rotatable bond counts does the compound with PubChem CID 395460 have?

It has 2 rotatable bond counts.

What is the complexity value of the compound with PubChem CID 395460?

The complexity value is 362.

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