2-Methylthiothiazole

CAS

5053-24-7

Catalog Number

ACM5053247

Category

Other Products

Molecular Weight

131.22

Molecular Formula

C₄H₅NS₂

MSDS COA Spec Sheet

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Specification

Synonyms

2-Methylthio-1,3-thiazole, 558524_ALDRICH, ZINC02570798, CID2760100, 5053-24-7

IUPAC Name

2-methylsulfanyl-1,3-thiazole

Canonical SMILES

CSC1=NC=CS1

InChI Key

VQNOAXZUEKPSJC-UHFFFAOYSA-N

Boiling Point

205-207ºC

Flash Point

91ºC

Density

1.271

Exact Mass

130.98600

Hazard Statements

Xi:Irritant;

H-Bond Acceptor

H-Bond Donor

Safety Description

S26-S36

WGK Germany

Upstream Synthesis Route 1

5685-05-2
74-88-4

5053-24-7

Reference: [1]Nuhn; Wagner
[Archiv der Pharmazie und Berichte der Deutschen Pharmazeutischen Gesellschaft, 1968, vol. 301, # 3, p. 186 - 200]
[2]Dou,H.J.M. et al.
[Helvetica Chimica Acta, 1978, vol. 61, p. 3143 - 3148]

Upstream Synthesis Route 2

19975-56-5

5053-24-7

Reference: [1]Journal of Organic Chemistry,1978,vol. 43,p. 1624 - 1626

Downstream Synthesis Route 1

5053-24-7

69749-85-5

Reference: [1]Dai, Wen; Shang, Sensen; Lv, Ying; Li, Guosong; Li, Chunsen; Gao, Shuang
[ACS Catalysis, 2017, vol. 7, # 7, p. 4890 - 4895]
[2]Vernin,G. et al.
[Journal of Heterocyclic Chemistry, 1978, vol. 15, p. 1361 - 1366]

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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