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Product Name: 5-Allyl-5-(1-methylallyl)-2-thiobarbituric acid sodium salt (CAS NO.66941-77-3)
Molecular Formula: C11H13N2O2S•Na
Molecular Weight: 260.31g/mol
Mol File: 66941-77-3.mol
H-Bond Donor: 1
H-Bond Acceptor: 3
IUPAC Name: sodium 5-but-3-en-2-yl-4,6-dioxo-5-prop-2-enyl-1H-pyrimidine-2-thiolate
Canonical SMILES: CC(C=C)C1(C(=O)NC(=NC1=O)[S-])CC=C.[Na+]
InChI: InChI=1S/C11H14N2O2S.Na/c1-4-6-11(7(3)5-2)8(14)12-10(16)13-9(11)15;/h4-
5,7H,1-2,6H2,3H3,(H2,12,13,14,15,16);/q;+1/p-1
InChIKey: GRDNWFXUKBSXGR-UHFFFAOYSA
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
rabbit | LD50 | intravenous | 58mg/kg (58mg/kg) | BEHAVIORAL: TREMOR BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 34, Pg. 183, 1945. |
rat | LD50 | intraperitoneal | 126mg/kg (126mg/kg) | BEHAVIORAL: TREMOR BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 34, Pg. 183, 1945. |
Poison by intraperitoneal and intravenous routes. When heated to decomposition it emits very toxic fumes of SOx, Na2O, and NOx. See also BARBITURATES and ALLYL COMPOUNDS.
5-Allyl-5-(1-methylallyl)-2-thiobarbituric acid sodium salt ,its CAS NO. is 66941-77-3,the synonyms is Barbituric acid, 5-allyl-5-(1-methylallyl)-2-thio-, sodium salt .