161950

1,3-Diethyl-2-thiobarbituric acid

99%

• 동의어(들): 1,3-Diethyl-2-sulfanylidene-1,3-diazinane-4,6-dione, 1,3-Diethyldihydro-2-thioxo-4,6(1H,5H)-pyrimidinedione, 1,3-Diethylthiobarbituric acid, N,N′-Diethyl-2-thiobarbituric acid
• 실험식(Hill 표기법): C₈H₁₂N₂O₂S
• CAS Number: 5217-47-0
• Molecular Weight: 200.26
• EC Number: 226-010-7
• MDL number: MFCD00006676
• UNSPSC 코드: 12352100
• PubChem Substance ID: 24849962
• NACRES: NA.22

속성

• Quality Level: 100
• 분석: 99%
• 약물 제어: regulated under CDSA - not available from Sigma-Aldrich Canada
• mp: 109-112 °C (lit.)
• solubility: 1 M NaOH: soluble 50 mg/mL, clear, colorless to light yellow
• SMILES string: CCN1C(=O)CC(=O)N(CC)C1=S
• InChI: 1S/C8H12N2O2S/c1-3-9-6(11)5-7(12)10(4-2)8(9)13/h3-5H2,1-2H3
• InChI key: SHBTUGJAKBRBBJ-UHFFFAOYSA-N

설명

애플리케이션

1,3-Diethyl-2-thiobarbituric acid (DETBA) was used as coinitiator during the photopolymerization of dental materials. It was used as reagent in electrochemical oxidation of 3,4-dihydroxybenzoic acid to yield benzofuro[2,3-d]pyrimidine derivatives. It was used in DETBA assay for determination of nicotine metabolites in human urine by HPLC.

안전성 정보

• 픽토그램: GHS06
• 신호어: Danger
• 유해 및 위험 성명서: H301,H317
• 예방조치 성명서: P280 - P301 + P310 + P330 - P302 + P352
• Hazard Classifications: Acute Tox. 3 Oral - Skin Sens. 1
• Storage Class Code: 6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
• WGK: WGK 3
• Flash Point (°F): Not applicable
• Flash Point (°C): Not applicable