2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(3-methyl-1-buten-1-yl)-5-(1-methylethyl)-, sodium salt (1:1)

Modify Date: 2025-10-08 13:35:07

2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(3-methyl-1-buten-1-yl)-5-(1-methylethyl)-, sodium salt (1:1) structure	Common Name	2,4,6(1H,3H,5H)-Pyrimidinetrione,5-(3-methyl-1-buten-1-yl)-5-(1-methylethyl)-, sodium salt (1:1)
	CAS Number	64038-30-8	Molecular Weight	261.27300
	Density	1.146g/cm3	Boiling Point	N/A
	Molecular Formula	C₁₂H₁₈N₂NaO₃+	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	sodium,5-[(E)-3-methylbut-1-enyl]-5-propan-2-yl-1,3-diazinane-2,4,6-trione
Synonym	More Synonyms

Density	1.146g/cm3
Molecular Formula	C₁₂H₁₈N₂NaO₃+
Molecular Weight	261.27300
Exact Mass	261.12200
PSA	75.27000
LogP	1.86460
Index of Refraction	1.53
InChIKey	PPHNDBIJXSMJTN-IPZCTEOASA-M
SMILES	CC(C)C=CC1(C(C)C)C(=O)[N-]C(=O)NC1=O.[Na+]

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CQ7100000

CHEMICAL NAME :: Barbituric acid, 5-isopropyl-5-(3-methyl-1-butenyl)-, sodium salt

CAS REGISTRY NUMBER :: 64038-30-8

LAST UPDATED :: 199107

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C12-H18-N2-O3.Na

MOLECULAR WEIGHT :: 261.31

WISWESSER LINE NOTATION :: T6VMVMV FHJ FY1&1 F2Y1&U1 &-NA-

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 104 mg/kg

TOXIC EFFECTS :: Behavioral - general anesthetic Behavioral - tremor

REFERENCE :: JAPMA8 Journal of the American Pharmaceutical Association, Scientific Edition. (Washington, DC) V.29-49, 1940-60. For publisher information, see JPMSAE. Volume(issue)/page/year: 44,152,1955

5-Isopropyl-5-(3-methyl-1-butenyl)-2-sodiooxy-4,6(1H,5H)-pyrimidinedione

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