5-Pyrimidinecarboxylicacid, 1,2,3,4-tetrahydro-4-oxo-2-thioxo-, ethyl ester

Names

[ Name ]:
5-Pyrimidinecarboxylicacid, 1,2,3,4-tetrahydro-4-oxo-2-thioxo-, ethyl ester

[Synonym ]:
Ethyl 4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Ethyl 4-oxo-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
Ethyl-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-carboxylat
5-pyrimidinecarboxylic acid, 1,6-dihydro-2-mercapto-6-oxo-, ethyl ester
Ethyl 6-oxo-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate
ethyl 4-oxo-2-sulfanylidene-1H-pyrimidine-5-carboxylate
Ethyl 2-thiouracil-5-carboxylate
EINECS 253-749-2
5-pyrimidinecarboxylic acid, 4-hydroxy-2-mercapto-, ethyl ester
MFCD00006074
5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-oxo-2-thioxo-, ethyl ester
ethyl 4-hydroxy-2-mercaptopyrimidine-5-carboxylate
ethyl 4-hydroxy-2-sulfanylpyrimidine-5-carboxylate

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Melting Point ]:
249-255 °C (dec.)(lit.)

[ Molecular Formula ]:
C₇H₈N₂O₃S

[ Molecular Weight ]:
200.215

[ Exact Mass ]:
200.025558

[ PSA ]:
111.11000

[ LogP ]:
-0.20

[ Index of Refraction ]:
1.607

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UV7775000

CHEMICAL NAME :: 5-Pyrimidinecarboxylic acid, 4-hydroxy-2-mercapto-, ethyl ester

CAS REGISTRY NUMBER :: 38026-46-9

LAST UPDATED :: 199012

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C7-H8-N2-O3-S

MOLECULAR WEIGHT :: 200.23

WISWESSER LINE NOTATION :: T6N CNJ BSH DQ EVO2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 250 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD691-490

Safety Information

[ Safety Phrases ]:
S24/25

[ WGK Germany ]:
3

[ RTECS ]:
UV7775000

[ HS Code ]:
2933599090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Customs

[ HS Code ]: 2933599090

[ Summary ]:
2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%