4-Chloro-6-methoxy-2-(methylthio)pyrimidine,98%

CAS

89466-42-2

Catalog Number

ACM89466422

Category

Other Products

Molecular Weight

190.65

Molecular Formula

C₆H₇ClN₂OS

MSDS COA Spec Sheet

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Specification

Synonyms

89466-42-2, 4-Chloro-6-methoxy-2-(methylthio)pyrimidine, 4-chloro-6-methoxy-2-methylsulfanyl-pyrimidine, MolPort-021-783-379, AKOS006302468, QC-5706, RP25025, AK-53573, AM101517, HC210537, KB-38087, AB1009726, FT-0687950, 4-Chloro-6-methoxy-2-(methylthio)pyrimidine ,98%

IUPAC Name

4-chloro-6-methoxy-2-methylsulfanylpyrimidine

Canonical SMILES

COC1=CC(=NC(=N1)SC)Cl

InChI Key

FNYLFWGITLMOHA-UHFFFAOYSA-N

Boiling Point

288ºC

Melting Point

38-39ºC

Flash Point

128ºC

Density

1.36

Exact Mass

189.99700

H-Bond Acceptor

H-Bond Donor

Upstream Synthesis Route 1

67-56-1
6299-25-8

89466-42-2

Reference: [1] Heterocycles, 2014, vol. 89, # 8, p. 1933 - 1939
[2] Synthetic Communications, 2018, vol. 48, # 6, p. 714 - 720
[3] Patent: US5599770, 1997, A,
[4] Patent: US5723412, 1998, A,
[5] Bioorganic and Medicinal Chemistry Letters, 2012, vol. 22, # 5, p. 1940 - 1943

Upstream Synthesis Route 2

6299-25-8
124-41-4

89466-42-2

Reference: [1] ACS Medicinal Chemistry Letters, 2015, vol. 6, # 8, p. 942 - 947
[2] Patent: US2007/117818, 2007, A1, . Location in patent: Page/Page column 11-12; 23
[3] Patent: WO2004/63192, 2004, A1, . Location in patent: Page 25
[4] Patent: WO2013/66729, 2013, A1, . Location in patent: Page/Page column 38

Upstream Synthesis Route 3

6299-25-8
124-41-4

89466-42-2

Reference: [1]ACS Medicinal Chemistry Letters,2015,vol. 6,p. 942 - 947
[2]Patent: US2007/117818,2007,A1 .Location in patent: Page/Page column 11-12; 23
[3]Patent: WO2004/63192,2004,A1 .Location in patent: Page 25
[4]Patent: WO2013/66729,2013,A1 .Location in patent: Page/Page column 38