5-Pyrimidinecarboxylicacid, 1-(2-fluorophenyl)-1,6-dihydro-2-(methylthio)-6-oxo-, ethyl ester

Modify Date: 2025-08-28 06:59:27

5-Pyrimidinecarboxylicacid, 1-(2-fluorophenyl)-1,6-dihydro-2-(methylthio)-6-oxo-, ethyl ester Structure
5-Pyrimidinecarboxylicacid, 1-(2-fluorophenyl)-1,6-dihydro-2-(methylthio)-6-oxo-, ethyl ester structure
Common Name 5-Pyrimidinecarboxylicacid, 1-(2-fluorophenyl)-1,6-dihydro-2-(methylthio)-6-oxo-, ethyl ester
CAS Number 82636-12-2 Molecular Weight 308.32800
Density 1.32g/cm3 Boiling Point 420ºC at 760mmHg
Molecular Formula C14H13FN2O3S Melting Point N/A
MSDS N/A Flash Point 207.8ºC

 Names

Name ethyl 1-(2-fluorophenyl)-2-methylsulfanyl-6-oxopyrimidine-5-carboxylate

 Chemical & Physical Properties

Density 1.32g/cm3
Boiling Point 420ºC at 760mmHg
Molecular Formula C14H13FN2O3S
Molecular Weight 308.32800
Flash Point 207.8ºC
Exact Mass 308.06300
PSA 86.49000
LogP 2.27020
Index of Refraction 1.596
InChIKey ITDIAJUUYDEGEU-UHFFFAOYSA-N
SMILES CCOC(=O)c1cnc(SC)n(-c2ccccc2F)c1=O

 Synthetic Route

~54%

5-Pyrimidinecarboxylicacid, 1-(2-fluorophenyl)-1,6-dihydro-2-(methylthio)-6-oxo-, ethyl ester Structure

5-Pyrimidinecar...

CAS#:82636-12-2

Literature: Gupta, K. A.; Saxena, Anil K.; Jain, Padam C. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, # 3 p. 228 - 233

~59%

5-Pyrimidinecarboxylicacid, 1-(2-fluorophenyl)-1,6-dihydro-2-(methylthio)-6-oxo-, ethyl ester Structure

5-Pyrimidinecar...

CAS#:82636-12-2

Literature: Gupta, K. A.; Saxena, Anil K.; Jain, Padam C. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, # 3 p. 228 - 233

~%

5-Pyrimidinecarboxylicacid, 1-(2-fluorophenyl)-1,6-dihydro-2-(methylthio)-6-oxo-, ethyl ester Structure

5-Pyrimidinecar...

CAS#:82636-12-2

Literature: Gupta, K. A.; Saxena, Anil K.; Jain, Padam C. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, # 3 p. 228 - 233

~%

5-Pyrimidinecarboxylicacid, 1-(2-fluorophenyl)-1,6-dihydro-2-(methylthio)-6-oxo-, ethyl ester Structure

5-Pyrimidinecar...

CAS#:82636-12-2

Literature: Gupta, K. A.; Saxena, Anil K.; Jain, Padam C. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, # 3 p. 228 - 233

~%

5-Pyrimidinecarboxylicacid, 1-(2-fluorophenyl)-1,6-dihydro-2-(methylthio)-6-oxo-, ethyl ester Structure

5-Pyrimidinecar...

CAS#:82636-12-2

Literature: Gupta, K. A.; Saxena, Anil K.; Jain, Padam C. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, # 3 p. 228 - 233
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