Sodium 2-Thiobarbiturate - ≥98%(T) , CAS No.31645-12-2

CAS: 31645-12-2 Cat. No.: S161323 Peso molecular: 166.13 PubChem CID: 56924476
Disponible para pedir
GRADE & PURITY ≥98%(T)
Synonyms
2-Thiobarbituric Acid Sodium Salt | AKOS015854533 | LHWPSDLHLAAELL-UHFFFAOYSA-N | Sodium 2-Thiobarbiturate | 2-THIOBARBITURIC ACID, SODIUM DERIVATIVE
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5g
S161323-5g
≥10
16,90US$
25g
S161323-25g
3
43,90US$
100g
S161323-100g
5
116,90US$
500g
S161323-500g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
578,90US$
Enter a quantity for the sizes you want to add.
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Why this grade

≥98%(T) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
2-Thiobarbituric Acid Sodium Salt | AKOS015854533 | LHWPSDLHLAAELL-UHFFFAOYSA-N | Sodium 2-Thiobarbiturate | 2-THIOBARBITURIC ACID, SODIUM DERIVATIVE
Especificaciones y pureza
≥98%(T)
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥98%(T)
Nombres e identificadores
Pubchem Sid488201784
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488201784
Sonrisas canónicasC1C(=O)NC(=S)NC1=O.[Na]
InChIKeyLHWPSDLHLAAELL-UHFFFAOYSA-N
INCHI1S/C4H4N2O2S.Na/c7-2-1-3(8)6-4(9)5-2;/h1H2,(H2,5,6,7,8,9);
Isómeros SMILES C1C(=O)NC(=S)NC1=O.[Na]
PubChem CID 56924476
Peso molecular 166.13

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClaseDiazines
SubclassPyrimidines and pyrimidine derivatives
Intermediate Tree Nodes Pyrimidones
Direct ParentThiobarbituric acid derivatives
Alternative Parents Diazinanes  1,3-dicarbonyl compounds  Thioureas  Organic alkali metal salts  Carboxylic acids and derivatives  Azacyclic compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAliphatic heteromonocyclic compounds
Substituents Thiobarbiturate - 1,3-diazinane - 1,3-dicarbonyl compound - Thiourea - Carboxylic acid derivative - Azacycle - Organic alkali metal salt - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Aliphatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as thiobarbituric acid derivatives. These are organic compounds containing a 2-thioxodihydropyrimidine-4,6(1H,5H)-dione skeleton.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

9 results found

Lot NumberCertificate TypeFechaArticulo
B2628213Certificate of AnalysisMar 13, 2026 S161323
H2117388Certificate of AnalysisJun 09, 2025 S161323
H2117389Certificate of AnalysisJun 09, 2025 S161323
I2509624Certificate of AnalysisJun 22, 2024 S161323
I2509634Certificate of AnalysisJun 22, 2024 S161323
I2509676Certificate of AnalysisJun 22, 2024 S161323
C1912161Certificate of AnalysisJan 05, 2023 S161323
L2206143Certificate of AnalysisDec 16, 2022 S161323
L2201103Certificate of AnalysisDec 10, 2022 S161323
Propiedades químicas y físicas
Peso molecular167.140 g/mol
XLogP3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass166.989 Da
Monoisotopic Mass166.989 Da
Topological Polar Surface Area90.300 Ų
Heavy Atom Count10
Formal Charge0
Complexity171.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count2
Calculadoras de soluciones
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