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Merck

161950

Sigma-Aldrich

1,3-Diethyl-2-thiobarbitursäure

99%

Synonym(e):

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

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About This Item

Empirische Formel (Hill-System):
C8H12N2O2S
CAS-Nummer:
Molekulargewicht:
200.26
EG-Nummer:
MDL-Nummer:
UNSPSC-Code:
12352100
PubChem Substanz-ID:
NACRES:
NA.22

Assay

99%

Arzneimittelkontrolle

regulated under CDSA - not available from Sigma-Aldrich Canada

mp (Schmelzpunkt)

109-112 °C (lit.)

Löslichkeit

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

InChIKey

SHBTUGJAKBRBBJ-UHFFFAOYSA-N

Anwendung

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.

Piktogramme

Skull and crossbones

Signalwort

Danger

H-Sätze

Gefahreneinstufungen

Acute Tox. 3 Oral - Skin Sens. 1

Lagerklassenschlüssel

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 3

Flammpunkt (°F)

Not applicable

Flammpunkt (°C)

Not applicable


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IARC scientific publications, (74)(74), 183-193 (1986-01-01)
Three novel colorimetric methods of detecting urinary nicotine metabolites called the barbituric acid, diethylthiobarbituric acid (DETB) and DETB-extraction methods were evaluated for use as a simple cheap objective test of smoking. Urine samples were collected from 103 male smokers and
T Sakai et al.
Journal of chromatography. B, Biomedical sciences and applications, 726(1-2), 313-316 (1999-05-29)
The reaction conditions of 1,3-diethyl-2-thiobarbituric acid (DETBA)-malonaldehyde (MA) adduct formation were examined in order to analyze MA in fish tissue by high-performance liquid chromatography. A reaction mixture containing 4 mM butyl hydroxytoluene was heated at 100 degrees C for 150
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