4-Nitroindole - ≥98% , CAS No.4769-97-5

CAS: 4769-97-5 Cat. No.: N111479 Fórmula: C8H6N2O2 Peso molecular: 162.15 Beilstein Registry Number: 20(5)7,40 Número CE: 689-317-9
Disponível para encomenda
GRADE & PURITY ≥98%
Synonyms
Indole, 4-nitro- | Oprea1_676916 | AKOS000120821 | EN300-78054 | A7294 | LAVZKLJDKGRZJG-UHFFFAOYSA- | 4-Nitro-1H-indole # | SCHEMBL28549 | BBL027770 | Benzene, 2,4-dichloro-1,3-dimethyl-5-hydroxy- | AKOS002838736 | 4-Nitroindole | 5-Chloro-4-fluoroindole-
Storage
Argon charged,Room temperature
Shipped In
Normal
★
Size
Alemanha (EU)
USA*
Price
Qty
250mg
N111479-250mg
—
4 Em stock
8,59€
1g
N111479-1g
—
9 Em stock
9,46€
5g
N111479-5g
4 Em stock
9 Em stock

13,80€

20,74€
Gravar 6,94 € (33.47%)
10g
N111479-10g
Sob encomenda · 8–12 semanas

26,81€

40,70€
Gravar 13,88 € (34.12%)
25g
N111479-25g
—
2 Em stock

56,32€

84,95€
Gravar 28,64 € (33.71%)
100g
N111479-100g
—
1 Em stock

219,45€

329,65€
Gravar 110,20 € (33.43%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Argon charged,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.

Visão geral

Application:

4-Nitroindole was used in the synthesis of 1,3,4,5-tetrahydropyrrolo-[4,3,2-de]quinoline.

Reactant for preparation of:

Tryptophan dioxygenase inhibitors pyridyl-ethenyl-indoles as potential anticancer immunomodulators

Meridianin derivatives as protein kinase (PKC) inhibitors and vitro antiproliferative agents

Anti-angiogenic agents

Sodium-dependent glucose co-transporter 2 (SGLT2) inhibitors for the management of hyperglycemia in diabetes

Biologically active indoles

CGRP receptor antagonists

Nucleosides

CB2 cannabinoid receptor ligands

Specifications

Sinónimos
Indole, 4-nitro- | Oprea1_676916 | AKOS000120821 | EN300-78054 | A7294 | LAVZKLJDKGRZJG-UHFFFAOYSA- | 4-Nitro-1H-indole # | SCHEMBL28549 | BBL027770 | Benzene, 2,4-dichloro-1,3-dimethyl-5-hydroxy- | AKOS002838736 | 4-Nitroindole | 5-Chloro-4-fluoroindole-
Especificações e pureza
≥98%
Condições de armazenamento de armazenamento
Argon charged,Room temperature
Enviado em
Normal
Pureza
≥98%
Nomes e identificadores
Pubchem Sid488188193
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488188193
Sorrisos canónicosC1=CC2=C(C=CN2)C(=C1)[N+](=O)[O-]
IUPAC Name4-nitro-1H-indole
InChIKeyLAVZKLJDKGRZJG-UHFFFAOYSA-N
INCHI1S/C8H6N2O2/c11-10(12)8-3-1-2-7-6(8)4-5-9-7/h1-5,9H
SMILES isoméricas C1=CC2=C(C=CN2)C(=C1)[N+](=O)[O-]
WGK Alemanha 3
Peso molecular 162.15
Beilstein 20(5)7,40
Reaxy-Rn 136022
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=136022&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
SuperclassOrganoheterocyclic compounds
ClasseIndoles and derivatives
SubclassIndoles
Intermediate Tree Nodes Not available
Direct ParentIndoles
Alternative Parents Nitroaromatic compounds  Benzenoids  Pyrroles  Heteroaromatic compounds  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Indole - Nitroaromatic compound - Benzenoid - Pyrrole - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Organic oxoazanium - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
DescriçãoThis compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
External Descriptors Not available
Estrutura 3D
Modelo de Estrutura Química Interativa





Mecanismos de ação
Certificados(CoA,COO,BSE/TSE e Mapa de Análise)
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.

13 results found

Lot NumberCertificate TypeDataItem
C1816115Certificate of AnalysisOct 14, 2025 N111479
C1816116Certificate of AnalysisOct 14, 2025 N111479
I1219063Certificate of AnalysisJun 12, 2025 N111479
E2309806Certificate of AnalysisMay 18, 2023 N111479
C2627037Certificate of AnalysisMay 15, 2023 N111479
E2309798Certificate of AnalysisMay 15, 2023 N111479
E2309847Certificate of AnalysisMay 15, 2023 N111479
E2309848Certificate of AnalysisMay 15, 2023 N111479
E2309850Certificate of AnalysisMay 15, 2023 N111479
E2309851Certificate of AnalysisMay 15, 2023 N111479
E2309857Certificate of AnalysisMay 15, 2023 N111479
E2309858Certificate of AnalysisMay 15, 2023 N111479
D2321385Certificate of AnalysisJan 22, 2022 N111479

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Propriedades químicas e físicas
SensibilidadeAir Sensitive
Ponto de fusão (°C)205-207°C
Peso molecular162.150 g/mol
XLogP32.600
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass162.043 Da
Monoisotopic Mass162.043 Da
Topological Polar Surface Area61.600 Ų
Heavy Atom Count12
Formal Charge0
Complexity190.000
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 soluções
Revisões

Avaliações dos Clientes

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