Dimethyl 2-(5-chloro-3-nitropyridin-2-yl)malonate - ≥98% , CAS No.1261956-26-6

CAS: 1261956-26-6 Cat. No.: D180895 Peso molecular: 288.6 PubChem CID: 53217429
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
dimethyl 2-(5-chloro-3-nitropyridin-2-yl)propanedioate | DIMETHYL 2-(5-CHLORO-3-NITROPYRIDIN-2-YL)MALONATE | D75075 | AKOS015849005 | DTXSID80682469 | 1261956-26-6 | Dimethyl2-(5-chloro-3-nitropyridin-2-yl)malonate | MFCD18311907 | A889542 | Propanedioic
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1g
D180895-1g
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44,90US$

67,90US$
Guardar 23,00 US$ (33.87%)
5g
D180895-5g
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167,90US$

251,90US$
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25g
D180895-25g
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447,90US$

671,90US$
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100g
D180895-100g
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1.433,90US$

2.150,90US$
Guardar 717,00 US$ (33.33%)
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Why this grade

≥98% 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
dimethyl 2-(5-chloro-3-nitropyridin-2-yl)propanedioate | DIMETHYL 2-(5-CHLORO-3-NITROPYRIDIN-2-YL)MALONATE | D75075 | AKOS015849005 | DTXSID80682469 | 1261956-26-6 | Dimethyl2-(5-chloro-3-nitropyridin-2-yl)malonate | MFCD18311907 | A889542 | Propanedioic
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥98%
Nombres e identificadores
Sonrisas canónicasCOC(=O)C(C1=C(C=C(C=N1)Cl)[N+](=O)[O-])C(=O)OC
IUPAC Namedimethyl 2-(5-chloro-3-nitropyridin-2-yl)propanedioate
InChIKeyUVSRKEGGVVTQFK-UHFFFAOYSA-N
INCHI1S/C10H9ClN2O6/c1-18-9(14)7(10(15)19-2)8-6(13(16)17)3-5(11)4-12-8/h3-4,7H,1-2H3
Isómeros SMILES COC(=O)C(C1=C(C=C(C=N1)Cl)[N+](=O)[O-])C(=O)OC
PubChem CID 53217429
Peso molecular 288.6

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
SuperclassOrganic 1,3-dipolar compounds
ClaseAllyl-type 1,3-dipolar organic compounds
SubclassOrganic nitro compounds
Intermediate Tree Nodes C-nitro compounds
Direct ParentNitroaromatic compounds
Alternative Parents Pyridines and derivatives  1,3-dicarbonyl compounds  Aryl chlorides  Dicarboxylic acids and derivatives  Heteroaromatic compounds  Methyl esters  Propargyl-type 1,3-dipolar organic compounds  Azacyclic compounds  Organic oxoazanium compounds  Organic zwitterions  Hydrocarbon derivatives  Organochlorides  Organonitrogen compounds  Organic oxides  Organopnictogen compounds  Organic salts  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Nitroaromatic compound - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Pyridine - 1,3-dicarbonyl compound - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Carboxylic acid derivative - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organochloride - Organic zwitterion - Organohalogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as nitroaromatic compounds. These are c-nitro compounds where the nitro group is C-substituted with an aromatic 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
Peso molecular288.640 g/mol
XLogP31.300
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass288.015 Da
Monoisotopic Mass288.015 Da
Topological Polar Surface Area111.000 Ų
Heavy Atom Count19
Formal Charge0
Complexity356.000
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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