Name: Nitrobenzene Standard - analytischer Standard , CAS No.98-95-3
SKU: N116220
Availability: InStock

Nitrobenzene Standard - analytischer Standard , CAS No.98-95-3

CAS: 98-95-3 Cat. No.: N116220 Summenformel: C₆H₅NO₂ Molekulargewicht: 123.11 Beilstein Registry Number: 507540 EG-Nummer: 202-716-0

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GRADE & PURITY Analytical standard ?

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Übersicht Specifications Namen und Kennungen Documentation Advanced Data Taxonomic Classification 3D-Struktur Zugehörige Ziele (menschlich) Zugehörige Ziele (nicht menschlich) Wirkungsmechanismen Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm) Chemische und physikalische Eigenschaften FAQs und Artikel Citations of This Product Lösungsrechner Bewertungen

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Why this grade

analytischer Standard Analytischer Standard for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Room temperature Ships FedEx DG Service 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 278 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Übersicht

Nitrobenzol ist eine organische Verbindung, die als Standard für den Nachweis und die Analyse sowie für die Entfernung von Nitrobenzol aus der Umwelt verwendet wird. Die zytotoxische Wirkung der Verbindung wurde an einer Hepatokarzinom-Zelllinie untersucht.

Specifications

Synonyme

Spezifikationen & Reinheit

analytischer Standard

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Note

Analytischer Standard

Namen und Kennungen

Pubchem Sid	528774008
Kanonisches Lächeln	C1=CC=C(C=C1)[N+](=O)[O-]
IUPAC Name	nitrobenzene
InChIKey	LQNUZADURLCDLV-UHFFFAOYSA-N
INCHI	1S/C6H5NO2/c8-7(9)6-4-2-1-3-5-6/h1-5H
Isomere SMILES	C1=CC=C(C=C1)[N+](=O)[O-]
WGK Deutschland	2
RTECS	DA6475000
UN-Nummer	1662
Verpackungsgruppe	II
Molekulargewicht	123.11
Beilstein	507540
Reaxy-Rn	507540
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=507540&ln=

Documentation

📋 Safety Data Sheet (SDS)

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

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✅ 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.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Klasse Benzene and substituted derivatives
    - Subclass Nitrobenzenes

Kingdom	Organic compounds
Superclass	Benzenoids
Klasse	Benzene and substituted derivatives
Subclass	Nitrobenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Nitrobenzenes
Alternative Parents	Nitroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Nitrobenzene - Nitroaromatic compound - 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 - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic homomonocyclic compound
Beschreibung	This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors	an aromatic compound
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

3D-Struktur

Zugehörige Ziele (menschlich)

ALB Tchem Serum albumin (2651 Activities)

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ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

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NR1H4 Tclin Bile acid receptor FXR (6228 Activities)

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GSR Tclin Glutathione reductase (335 Activities)

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HepG2 (196354 Activities)

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Zugehörige Ziele (nicht menschlich)

Salmonella typhimurium (15756 Activities)

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Leishmania infantum (5912 Activities)

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Trypanosoma brucei brucei (13300 Activities)

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Lithobates pipiens (29 Activities)

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Rattus norvegicus (775804 Activities)

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E Lysozyme (95 Activities)

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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.

9 results found

Lot Number	Certificate Type	Datum	Artikel
F2103206	Certificate of Analysis	Sep 03, 2026	N116220
G2431129	Certificate of Analysis	May 09, 2026	N116220
L2307179	Certificate of Analysis	Sep 08, 2025	N116220
K2219359	Certificate of Analysis	Aug 23, 2024	N116220
K2219362	Certificate of Analysis	Aug 23, 2024	N116220
G2431122	Certificate of Analysis	Aug 07, 2024	N116220
F2214676	Certificate of Analysis	Mar 15, 2023	N116220
F2214677	Certificate of Analysis	Mar 15, 2023	N116220
K2012037	Certificate of Analysis	Sep 16, 2022	N116220

Chemische und physikalische Eigenschaften

Empfindlichkeit	Light sensitive.
Brechungsindex	1.5529
Flammpunkt (°C)	88℃
Siedepunkt (°C)	210-211°C
Schmelzpunkt (°C)	6°C
Molekulargewicht	123.110 g/mol
XLogP3	1.900
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	123.032 Da
Monoisotopic Mass	123.032 Da
Topological Polar Surface Area	45.800 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	102.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

FAQs und Artikel

From “Reduction First, Then Acylation” to “Direct Amidation”: An Unconventional Route to Amide Bond Formation from Nitro and Nitroso Substrates with α-Keto Carboxylic Acids

Categories: Technical Articles: Reagent Chemistry, Synthesis & Bioscience Guides

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Amidation reaction Amide bond construction Nitro compounds

From Molecular Design to Morphology Control: How Small-Molecule Donors Improve the Efficiency, Stability, and Processability of Organic Solar Cells

Categories: Technical Articles: Reagent Chemistry, Synthesis & Bioscience Guides

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Small molecule Organic solar cells

From Molecular Design to Morphology Control: How Small-Molecule Donors Improve the Efficiency, Stability, and Processability of Organic Solar Cells

Categories: Technical Articles: Reagent Chemistry, Synthesis & Bioscience Guides

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Small molecule Organic solar cells

From Nitroarenes to Pharmaceutically Relevant Pyridines: A Photochemically Induced Aryl Nitrene-Mediated Skeletal Editing Strategy

Categories: Technical Articles: Reagent Chemistry, Synthesis & Bioscience Guides

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Pyridine Nitroaromatic hydrocarbons

Citations of This Product

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Lösungsrechner

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Nitrobenzene Standard - analytischer Standard , CAS No.98-95-3

Storage & shipping

Quality documents

Literature proof

Übersicht

Specifications

Documentation

📋 Safety Data Sheet (SDS)

✅ Certificate of Analysis (COA)

📊 Datasheet

🔬 Specification Sheet

Advanced Data

Molarity Calculator

Dilution Calculator

Reconstitution Calculator

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