5-(2-Butenyl)-5-propylbarbituric acid sodium salt

Modify Date: 2025-09-19 19:49:58

5-(2-Butenyl)-5-propylbarbituric acid sodium salt Structure
5-(2-Butenyl)-5-propylbarbituric acid sodium salt structure
Common Name 5-(2-Butenyl)-5-propylbarbituric acid sodium salt
CAS Number 67050-14-0 Molecular Weight 247.24600
Density 1.095g/cm3 Boiling Point N/A
Molecular Formula C11H16N2NaO3+ Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name Barbituric acid, 5-(2-butenyl)-5-propyl-, sodium salt

 Chemical & Physical Properties

Density 1.095g/cm3
Molecular Formula C11H16N2NaO3+
Molecular Weight 247.24600
Exact Mass 247.10600
PSA 75.27000
LogP 1.76270
Index of Refraction 1.478
InChIKey MIURNBGIIWZAKX-WGCWOXMQSA-N
SMILES CC=CCC1(CCC)C(=O)NC(=O)NC1=O.[Na+]

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CQ1468000
CHEMICAL NAME :
Barbituric acid, 5-(2-butenyl)-5-propyl-, sodium salt
CAS REGISTRY NUMBER :
67050-14-0
LAST UPDATED :
199107
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H16-N2-O3.Na
MOLECULAR WEIGHT :
247.28
WISWESSER LINE NOTATION :
T6VMVNV FHJ F3 F2U2 &-NA- &23/6

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
321 mg/kg
TOXIC EFFECTS :
Behavioral - tremor Behavioral - convulsions or effect on seizure threshold
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: 34,183,1945
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