5-Allyl-5-(2-cyclopentenyl)-2-thiobarbituric acid supplier

Name
5-Allyl-5-(2-cyclopenten-1-yl)-2,3-dihydro-2-thioxo-4,6(1H,5H)-pyrimidinedione
EINECS
CAS No. 66941-60-4
Density 1.29g/cm³
Solubility
Melting Point
Formula C₁₂H₁₄N₂O₂S
Boiling Point °Cat760mmHg
Molecular Weight 250.34
Flash Point °C
Transport Information
Appearance
Safety Poison by intraperitoneal and intravenous routes. When heated to decomposition it emits very toxic fumes of NO_x and SO_x. See also BARBITURATES and ALLYL COMPOUNDS.
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Allyl-5-cyclopent-2-enyl-2-thio-barbitursaeure;5-allyl-5-cyclopent-2-enyl-2-thio-barbituric acid;
PSA 97.27000
LogP 1.59780

5-Allyl-5-(2-cyclopentenyl)-2-thiobarbituric acid Chemical Properties

Product Name: 5-Allyl-5-(2-cyclopentenyl)-2-thiobarbituric acid (CAS NO.66941-60-4)

Molecular Formula: C₁₂H₁₄N₂O₂S
Molecular Weight: 250.34g/mol
Mol File: 66941-60-4.mol
Density: 1.29 g/cm³
Surface Tension: 58.6 dyne/cm
XLogP3-AA: 1.9
H-Bond Donor: 2
H-Bond Acceptor: 2
IUPAC Name: 5-cyclopent-2-en-1-yl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,
6-dione
Canonical SMILES: C=CCC1(C(=O)NC(=S)NC1=O)C2CCC=C2
InChI: InChI=1S/C12H14N2O2S/c1-2-7-12(8-5-3-4-6-8)9(15)13-11(17)14-10(12)16/h2-
3,5,8H,1,4,6-7H2,(H2,13,14,15,16,17)
InChIKey: QCARJOPGJNPBPJ-UHFFFAOYSA-N

5-Allyl-5-(2-cyclopentenyl)-2-thiobarbituric acid Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
rat	LD50	intraperitoneal	100mg/kg (100mg/kg)		Journal of the American Chemical Society. Vol. 65, Pg. 2091, 1943.
rat	LD50	intravenous	100mg/kg (100mg/kg)		Journal of the American Chemical Society. Vol. 65, Pg. 2091, 1943.

5-Allyl-5-(2-cyclopentenyl)-2-thiobarbituric acid Safety Profile

Poison by intraperitoneal and intravenous routes. When heated to decomposition it emits very toxic fumes of NO_x and SO_x. See also BARBITURATES and ALLYL COMPOUNDS.

5-Allyl-5-(2-cyclopentenyl)-2-thiobarbituric acid Specification

5-Allyl-5-(2-cyclopentenyl)-2-thiobarbituric acid ,its CAS NO. is 66941-60-4,the synonyms is 4-24-00-02066 (Beilstein Handbook Reference) ; BRN 0234281 ; Barbituric acid, 5-allyl-5-(2-cyclopentenyl)-2-thio- .

Product Name

5-Allyl-5-(2-cyclopenten-1-yl)-2,3-dihydro-2-thioxo-4,6(1H,5H)-pyrimidinedione

5-Allyl-5-(2-cyclopentenyl)-2-thiobarbituric acid Chemical Properties

5-Allyl-5-(2-cyclopentenyl)-2-thiobarbituric acid Toxicity Data With Reference

5-Allyl-5-(2-cyclopentenyl)-2-thiobarbituric acid Safety Profile

5-Allyl-5-(2-cyclopentenyl)-2-thiobarbituric acid Specification

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