Name: 2-Thiouracil(2TU) - analytical standard , CAS No.141-90-2
Brand: Aladdin Scientific
SKU: T106705
Availability: InStock

2-Thiouracil(2TU) - analytical standard , CAS No.141-90-2

CAS: 141-90-2 Cat. No.: T106705 Summenformel: C₄H₄N₂OS Molekulargewicht: 128.15 Beilstein Registry Number: 112227 EG-Nummer: 205-508-8 PubChem CID: 1269845

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analytical standard Analytischer Standard für empfindliche chromatographische und analytische Workflows, die minimale Basislinieninterferenzen erfordern.

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Literaturbeleg

In 3 peer-reviewten Publikationen zu Chromatographie, organischer Synthese und Kreuzkupplungsreaktionen zitiert.

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Synonyme

Spezifikationen & Reinheit

analytical standard

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Analytischer Standard

Namen und Kennungen

Pubchem Sid

528757497

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528757497

Kanonisches Lächeln

C1=CNC(=S)NC1=O

IUPAC Name

2-sulfanylidene-1H-pyrimidin-4-one

InChIKey

ZEMGGZBWXRYJHK-UHFFFAOYSA-N

INCHI

1S/C4H4N2OS/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8)

Isomere SMILES

C1=CNC(=S)NC1=O

WGK Deutschland

RTECS

YR1575000

PubChem CID

1269845

Molekulargewicht

128.15

Beilstein

112227

Reaxy-Rn

112227

Dokumentation

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Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Klasse Diazines
    - Subclass Pyrimidines and pyrimidine derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Klasse	Diazines
Subclass	Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Pyrimidones
Alternative Parents	Pyrimidinethiones 2-Thiopyrimidines Hydropyrimidines Vinylogous amides Heteroaromatic compounds Thioureas Lactams Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	2-thiopyrimidine - Pyrimidinethione - Thiopyrimidine - Pyrimidone - Hydropyrimidine - Heteroaromatic compound - Vinylogous amide - Lactam - Thiourea - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Beschreibung	This compound belongs to the class of organic compounds known as pyrimidones. These are compounds that contain a pyrimidine ring, which bears a ketone. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors	a small molecule
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

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Caco-2 (12174 Activities)

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J774.A1 (2436 Activities)

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S91 (48 Activities)

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fba Putative fructose-1,6-bisphosphate aldolase (15559 Activities)

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ffp 4'-phosphopantetheinyl transferase ffp (24982 Activities)

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SARS-CoV-2 (38078 Activities)

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Wirkungsmechanismen

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Lot Number	Certificate Type	Datum	Artikel
H2429332	Certificate of Analysis	Jun 08, 2026	T106705
H1320044	Certificate of Analysis	Jan 10, 2023	T106705

Chemische und physikalische Eigenschaften

Schmelzpunkt (°C)	>300°C
Molekulargewicht	128.150 g/mol
XLogP3	-0.300
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	128.004 Da
Monoisotopic Mass	128.004 Da
Topological Polar Surface Area	73.200 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	163.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

FAQs und Artikel

Pyrimidine Research Selection Guide: Structural Features, Typical Applications, and a Reagent/Building-Block Classification Navigator (Tables 1–5)

Categories: Technical Articles: Reagent Chemistry, Synthesis & Bioscience Guides

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Pyrimidine Pyrimidine base

2-Thiouracil (2TU): Properties, Uses & Lab FAQ

Categories: Technical Articles: Reagent Chemistry, Synthesis & Bioscience Guides

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Pyrimidine 2-Thiouracil RNA Labeling Nucleobase Analog Biochemical Reagent

2-Thiouracil (2TU): Properties, Uses & FAQs

Categories: Technical Articles: Reagent Chemistry, Synthesis & Bioscience Guides

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2-Thiouracil RNA Labeling Pyrimidine Analog Nucleobase Analog metabolic labeling

2-Thiouracil (2TU): Properties, Applications & Lab Guidelines

Categories: Technical Articles: Reagent Chemistry, Synthesis & Bioscience Guides

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2-Thiouracil RNA Labeling Nucleobase Analog metabolic labeling Thyroid Research

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2-Thiouracil(2TU) - analytical standard , CAS No.141-90-2

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