Ronidazole-d3 - analytical standard , CAS No.1015855-87-4

CAS: 1015855-87-4 Cat. No.: R114337 Peso molecular: 203.17 PubChem CID: 16212243
Disponible para pedir
GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods.
Synonyms
AKOS030243121 | Ronidazole-d3, VETRANAL(TM), analytical standard | Ronidazole-d3 | [1-(?H?)methyl-5-nitro-1H-imidazol-2-yl]methyl carbamate | [1-(~2~H_3_)Methyl-5-nitro-1H-imidazol-2-yl]methyl carbamate | 1015855-87-4 | DTXSID30583598 | [5-nitro-1-(trideu
Storage
Room temperature
Shipped In
Normal
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Size
Estado
Price
Qty
10mg
R114337-10mg
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794,90US$

927,90US$
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Why this grade

analytical standard Analytical standard for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

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

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Quality documents

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

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Literature proof

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

Specifications

Sinónimos
AKOS030243121 | Ronidazole-d3, VETRANAL(TM), analytical standard | Ronidazole-d3 | [1-(?H?)methyl-5-nitro-1H-imidazol-2-yl]methyl carbamate | [1-(~2~H_3_)Methyl-5-nitro-1H-imidazol-2-yl]methyl carbamate | 1015855-87-4 | DTXSID30583598 | [5-nitro-1-(trideu
Especificaciones y pureza
analytical standard
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Grado
Analytical standard
Nombres e identificadores
Sonrisas canónicasCN1C(=CN=C1COC(=O)N)[N+](=O)[O-]
IUPAC Name[5-nitro-1-(trideuteriomethyl)imidazol-2-yl]methyl carbamate
InChIKeyPQFRTXSWDXZRRS-FIBGUPNXSA-N
INCHI1S/C6H8N4O4/c1-9-4(3-14-6(7)11)8-2-5(9)10(12)13/h2H,3H2,1H3,(H2,7,11)/i1D3
Isómeros SMILES [2H]C([2H])([2H])N1C(=CN=C1COC(=O)N)[N+](=O)[O-]
WGK Alemania 2
RTECS NI6803000
PubChem CID 16212243
Peso molecular 203.17

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.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClaseAzoles
SubclassImidazoles
Intermediate Tree Nodes Substituted imidazoles
Direct ParentNitroimidazoles
Alternative Parents Nitroaromatic compounds  1,2,5-trisubstituted imidazoles  N-substituted imidazoles  Heteroaromatic compounds  Carbamate esters  Organic carbonic acids and derivatives  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic zwitterions  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents 1,2,5-trisubstituted-imidazole - Nitroaromatic compound - Nitroimidazole - Trisubstituted imidazole - N-substituted imidazole - Carbamic acid ester - Heteroaromatic compound - C-nitro compound - Carbonic acid derivative - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Azacycle - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Aromatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as nitroimidazoles. These are compounds containing an imidazole ring which bears a nitro 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:
Propiedades químicas y físicas
Punto de fusión (°C)166-168° C
Peso molecular203.170 g/mol
XLogP3-0.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass203.073 Da
Monoisotopic Mass203.073 Da
Topological Polar Surface Area116.000 Ų
Heavy Atom Count14
Formal Charge0
Complexity240.000
Isotope Atom Count3
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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