2-Chloro-4,6-dinitrophenol - ≥97% , CAS No.946-31-6

CAS: 946-31-6 Cat. No.: C352397 Summenformel: C6H3N2O5Cl Molekulargewicht: 218.55 EG-Nummer: 213-419-0
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GRADE & PURITY ≥97%
Synonyms
WLN: WNR BQ CG ENW | 4-06-00-01386 (Beilstein Handbook Reference) | MFCD00024234 | 2-Chloro-4,6-dinitrophenol, 97% | AKOS015912807 | 2,4-Dinitro-6-chloro phenol | 2-chloranyl-4,6-dinitro-phenol | SCHEMBL2165473 | W-109623 | 2-Chloro-4,6-dinitrophenol | 2-
Storage
Room temperature
Shipped In
Normal
★
Size
Deutschland (EU)
USA*
Price
Qty
1g
C352397-1g
—
3 Auf Lager
35,49€
5g
C352397-5g
—
3 Auf Lager
125,74€
25g
C352397-25g
—
5 Auf Lager
398,21€
100g
C352397-100g
—
2 Auf Lager
1.126,24€
Enter a quantity for the sizes you want to add.
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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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Übersicht

Application:
2-Chloro-4,6-dinitrophenol was used in identification of components in chemical waste water and in effluents from biological wastewater treatment plant using electrospray ionization and tandem mass spectrometry.

Specifications

Synonyme
WLN: WNR BQ CG ENW | 4-06-00-01386 (Beilstein Handbook Reference) | MFCD00024234 | 2-Chloro-4,6-dinitrophenol, 97% | AKOS015912807 | 2,4-Dinitro-6-chloro phenol | 2-chloranyl-4,6-dinitro-phenol | SCHEMBL2165473 | W-109623 | 2-Chloro-4,6-dinitrophenol | 2-
Spezifikationen & Reinheit
≥97%
Storage
Room temperature
Verschickt in
Normal
Reinheit
≥97%
Namen und Kennungen
Pubchem Sid488181889
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488181889
Kanonisches LächelnC1=C(C=C(C(=C1[N+](=O)[O-])O)Cl)[N+](=O)[O-]
IUPAC Name2-chloro-4,6-dinitrophenol
InChIKeyPCBCIXWBAPIVDV-UHFFFAOYSA-N
INCHI1S/C6H3ClN2O5/c7-4-1-3(8(11)12)2-5(6(4)10)9(13)14/h1-2,10H
Isomere SMILES C1=C(C=C(C(=C1[N+](=O)[O-])O)Cl)[N+](=O)[O-]
UN-Nummer 3335
Verpackungsgruppe III
Molekulargewicht 218.55
Reaxy-Rn 1980567
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1980567&ln=

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
SuperclassBenzenoids
KlassePhenols
SubclassNitrophenols
Intermediate Tree Nodes Not available
Direct ParentDinitrophenols
Alternative Parents Nitrobenzenes  O-chlorophenols  Nitroaromatic compounds  Chlorobenzenes  Aryl chlorides  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organochlorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Dinitrophenol - Nitrobenzene - Nitroaromatic compound - 2-halophenol - 2-chlorophenol - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as dinitrophenols. These are organic aromatic compounds containing a benzene that carries a single phenol group and exactly two nitro groups.
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Wirkungsmechanismen
Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
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.

7 results found

Lot NumberCertificate TypeDatumArtikel
H2219376Certificate of AnalysisJun 06, 2025 C352397
H2219377Certificate of AnalysisJun 06, 2025 C352397
H2219378Certificate of AnalysisJun 06, 2025 C352397
H2219379Certificate of AnalysisJun 06, 2025 C352397
H2219259Certificate of AnalysisJun 18, 2022 C352397
H2219298Certificate of AnalysisJun 18, 2022 C352397
A2411329Certificate of AnalysisJun 14, 2022 C352397
Chemische und physikalische Eigenschaften
Schmelzpunkt (°C)110-114 °C (lit.)
Molekulargewicht218.550 g/mol
XLogP31.700
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Exact Mass217.973 Da
Monoisotopic Mass217.973 Da
Topological Polar Surface Area112.000 Ų
Heavy Atom Count14
Formal Charge0
Complexity250.000
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
Citations of This Product
Referenzen
1. Jiayue Dong, Peizeng Yang, Jing Chen, Yuefei Ji, Junhe Lu.  (2022)  Nitrophenolic byproducts formation during sulfate radical oxidation and their fate in simulated drinking water treatment processes.  WATER RESEARCH,      [PMID:36088770] [10.1016/j.watres.2022.119054]
Lösungsrechner
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