Tetrahydro-2-methyl-3-thioxo-1,2,4-triazine-5,6-dione - ≥97% , CAS No.58909-39-0

CAS: 58909-39-0 Cat. No.: T171104 Peso molecular: 159.17 Número EC: 261-490-1 PubChem CID: 3034640
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
DTXSID60207654 | SMR004701407 | AKOS025312531 | SR-01000944806 | UMWWHOXOVPIGFD-UHFFFAOYSA-N | 2-methyl-3-sulfanylidene-1,2,4-triazinane-5,6-dione | MLS006010407 | 2,5-Dihydro-6-Hydroxy-3-Mercapto-2-Methyl-5-Oxo-1,2,4-Triazine | EN300-92093 | J-509964 | S
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1g
T171104-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

13,90US$

20,90US$
Guardar 7,00 US$ (33.49%)
5g
T171104-5g
3

18,90US$

28,90US$
Guardar 10,00 US$ (34.60%)
25g
T171104-25g
3

45,90US$

68,90US$
Guardar 23,00 US$ (33.38%)
100g
T171104-100g
1

132,90US$

199,90US$
Guardar 67,00 US$ (33.52%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥97% 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
DTXSID60207654 | SMR004701407 | AKOS025312531 | SR-01000944806 | UMWWHOXOVPIGFD-UHFFFAOYSA-N | 2-methyl-3-sulfanylidene-1, 2, 4-triazinane-5, 6-dione | MLS006010407 | 2, 5-Dihydro-6-Hydroxy-3-Mercapto-2-Methyl-5-Oxo-1, 2, 4-Triazine | EN300-92093 | J-509964 | S
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥97%
Nombres e identificadores
Pubchem Sid504762360
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504762360
Sonrisas canónicasCN1C(=S)NC(=O)C(=O)N1
IUPAC Name2-methyl-3-sulfanylidene-1,2,4-triazinane-5,6-dione
InChIKeyUMWWHOXOVPIGFD-UHFFFAOYSA-N
INCHI1S/C4H5N3O2S/c1-7-4(10)5-2(8)3(9)6-7/h1H3,(H,6,9)(H,5,8,10)
Isómeros SMILES CN1C(=S)NC(=O)C(=O)N1
WGK Alemania 3
PubChem CID 3034640
Peso molecular 159.17

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
ClaseTriazines
SubclassTriazinethiones
Intermediate Tree Nodes Not available
Direct ParentTriazinethiones
Alternative Parents 1,2,4-triazines  Heteroaromatic compounds  Lactams  Azacyclic compounds  Organosulfur compounds  Organooxygen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Triazinethione - 1,2,4-triazine - Heteroaromatic compound - Lactam - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as triazinethiones. These are compounds containing a triazine ring which bears a thioketone group.
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.

1 results found

Lot NumberCertificate TypeFechaArticulo
D1903074Certificate of AnalysisFeb 21, 2022 T171104
Propiedades químicas y físicas
Peso molecular159.170 g/mol
XLogP3-0.400
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass159.01 Da
Monoisotopic Mass159.01 Da
Topological Polar Surface Area93.500 Ų
Heavy Atom Count10
Formal Charge0
Complexity215.000
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 Count1
Calculadoras de soluciones
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