Propanoic acid, 2-methyl-, hexahydro-2,4, 6-trioxo-5- (1-phenylethyl)-5-pyrimidinyl ester

Modify Date: 2024-02-20 01:03:54

Propanoic acid, 2-methyl-, hexahydro-2,4, 6-trioxo-5- (1-phenylethyl)-5-pyrimidinyl ester structure	Common Name	Propanoic acid, 2-methyl-, hexahydro-2,4, 6-trioxo-5- (1-phenylethyl)-5-pyrimidinyl ester
	CAS Number	37431-39-3	Molecular Weight	318.32500
	Density	1.29g/cm3	Boiling Point	N/A
	Molecular Formula	C₁₆H₁₈N₂O₅	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	[2,4,6-trioxo-5-(1-phenylethyl)-1,3-diazinan-5-yl] 2-methylpropanoate

Density	1.29g/cm3
Molecular Formula	C₁₆H₁₈N₂O₅
Molecular Weight	318.32500
Exact Mass	318.12200
PSA	101.57000
LogP	1.75170
Index of Refraction	1.567

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CQ7074400

CHEMICAL NAME :: Barbituric acid, 5-isobutyryloxy-5-(1-phenethyl)-

CAS REGISTRY NUMBER :: 37431-39-3

BEILSTEIN REFERENCE NO. :: 0763643

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C16-H18-N2-O5

MOLECULAR WEIGHT :: 318.36

WISWESSER LINE NOTATION :: T6VMVMV FHJ FY1&R& FOVY1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 100 mg/kg

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

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 17,1194,1974

HS Code	2933540000

HS Code	2933540000
Summary	2933540000 other derivatives of malonylurea (barbituric acid); salts thereof。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:20.0%