4-(isoxazol-4-yl)-2-(methylthio)pyrimidine

Modify Date: 2025-08-25 19:01:34

4-(isoxazol-4-yl)-2-(methylthio)pyrimidine Structure
4-(isoxazol-4-yl)-2-(methylthio)pyrimidine structure
Common Name 4-(isoxazol-4-yl)-2-(methylthio)pyrimidine
CAS Number 956721-96-3 Molecular Weight 193.22600
Density 1.366 g/cm3 Boiling Point 399.105ºC at 760 mmHg
Molecular Formula C8H7N3OS Melting Point N/A
MSDS N/A Flash Point 195.172ºC

 Names

Name 4-(2-methylsulfanylpyrimidin-4-yl)-1,2-oxazole
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.366 g/cm3
Boiling Point 399.105ºC at 760 mmHg
Molecular Formula C8H7N3OS
Molecular Weight 193.22600
Flash Point 195.172ºC
Exact Mass 193.03100
PSA 77.11000
LogP 1.85350
InChIKey VXQCJTIAOFAILS-UHFFFAOYSA-N
SMILES CSc1nccc(-c2cnoc2)n1

 Safety Information

HS Code 2934999090

 Synthetic Route

~80%

4-(isoxazol-4-yl)-2-(methylthio)pyrimidine Structure

4-(isoxazol-4-y...

CAS#:956721-96-3

Literature: PFIZER INC. Patent: WO2009/16460 A2, 2009 ; Location in patent: Page/Page column 40; 58 ; WO 2009/016460 A2

 Precursor & DownStream

Precursor  1

DownStream  1

 Customs

HS Code 2934999090
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

4-(isoxazol-4-yl)-2-(methylthio)pyrimidine
4-(2-(Methylthio)pyrimidin-4-yl)isoxazole
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