sodium 4,6-dioxo-5-[(E)-pent-2-en-2-yl]-5-propyl-1H-pyrimidin-2-olate

Modify Date: 2023-01-15 17:34:06

sodium 4,6-dioxo-5-[(E)-pent-2-en-2-yl]-5-propyl-1H-pyrimidin-2-olate Structure
sodium 4,6-dioxo-5-[(E)-pent-2-en-2-yl]-5-propyl-1H-pyrimidin-2-olate structure
 Common Name sodium 4,6-dioxo-5-[(E)-pent-2-en-2-yl]-5-propyl-1H-pyrimidin-2-olate
CAS Number 66842-96-4 Molecular Weight 261.27300
Density 1.095g/cm3 Boiling Point N/A
Molecular Formula C12H18N2NaO3+ Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name Barbituric acid, 5-(1-methyl-1-butenyl)-5-propyl-, sodium salt

 Chemical & Physical Properties

Density 1.095g/cm3
Molecular Formula C12H18N2NaO3+
Molecular Weight 261.27300
Exact Mass 261.12200
PSA 75.27000
LogP 2.15280
Index of Refraction 1.485

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CQ7171500
CHEMICAL NAME :
Barbituric acid, 5-(1-methyl-1-butenyl)-5-propyl-, sodium salt
CAS REGISTRY NUMBER :
66842-96-4
LAST UPDATED :
199009
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C12-H18-N2-O3.Na
MOLECULAR WEIGHT :
261.31
WISWESSER LINE NOTATION :
T6VMVMV FHJ FYU3 F3

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
245 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 68,22,1940
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
104 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 68,22,1940
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Chemsrc provides CAS#:66842-96-4 MSDS, density, melting point, boiling point, structure, etc. Its name is sodium 4,6-dioxo-5-[(E)-pent-2-en-2-yl]-5-propyl-1H-pyrimidin-2-olate>> amp version: sodium 4,6-dioxo-5-[(E)-pent-2-en-2-yl]-5-propyl-1H-pyrimidin-2-olate

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