6-Nitroquinoline - ≥98% , CAS No.613-50-3

CAS: 613-50-3 Cat. No.: N122687 Peso molecular: 174.16 Beilstein Registry Number: 136138 Número EC: 210-346-6
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
NSC 4141 | 5-20-07-00326 (Beilstein Handbook Reference) | InChI=1/C9H6N2O2/c12-11(13)8-3-4-9-7(6-8)2-1-5-10-9/h1-6 | UNII-7033583N3J | BBL034646 | BCP27373 | J-200080 | AC-5110 | AI3-08863 | CCRIS 456 | SR-01000473458-1 | A15691 | MFCD00006799 | AMY23304
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1g
N122687-1g
3

9,90US$

14,90US$
Guardar 5,00 US$ (33.56%)
5g
N122687-5g
9

10,90US$

16,90US$
Guardar 6,00 US$ (35.50%)
10g
N122687-10g
3

13,90US$

20,90US$
Guardar 7,00 US$ (33.49%)
25g
N122687-25g
5

33,90US$

50,90US$
Guardar 17,00 US$ (33.40%)
100g
N122687-100g
5

107,90US$

161,90US$
Guardar 54,00 US$ (33.35%)
500g
N122687-500g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

444,90US$

667,90US$
Guardar 223,00 US$ (33.39%)
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Why this grade

≥98% 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
NSC 4141 | 5-20-07-00326 (Beilstein Handbook Reference) | InChI=1/C9H6N2O2/c12-11(13)8-3-4-9-7(6-8)2-1-5-10-9/h1-6 | UNII-7033583N3J | BBL034646 | BCP27373 | J-200080 | AC-5110 | AI3-08863 | CCRIS 456 | SR-01000473458-1 | A15691 | MFCD00006799 | AMY23304
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥98%
Nombres e identificadores
Pubchem Sid488181492
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488181492
Sonrisas canónicasC1=CC2=C(C=CC(=C2)[N+](=O)[O-])N=C1
IUPAC Name6-nitroquinoline
InChIKeySMHPLBXIVNQFBA-UHFFFAOYSA-N
INCHI1S/C9H6N2O2/c12-11(13)8-3-4-9-7(6-8)2-1-5-10-9/h1-6H
Isómeros SMILES C1=CC2=C(C=CC(=C2)[N+](=O)[O-])N=C1
WGK Alemania 3
RTECS VC1900000
Peso molecular 174.16
Beilstein 136138
Reaxy-Rn 136138
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=136138&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
ClaseQuinolines and derivatives
SubclassNitroquinolines and derivatives
Intermediate Tree Nodes Not available
Direct ParentNitroquinolines and derivatives
Alternative Parents Nitroaromatic compounds  Pyridines and derivatives  Benzenoids  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 Nitroquinoline - Nitroaromatic compound - Pyridine - Benzenoid - 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
DescripciónThis compound belongs to the class of organic compounds known as nitroquinolines and derivatives. These are compounds containing a nitro group attached to a quinoline moiety.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
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.

12 results found

Lot NumberCertificate TypeFechaArticulo
I1317055Certificate of AnalysisApr 09, 2025 N122687
F2406102Certificate of AnalysisMar 23, 2024 N122687
F2406197Certificate of AnalysisMar 23, 2024 N122687
F2406198Certificate of AnalysisMar 23, 2024 N122687
A2419520Certificate of AnalysisNov 24, 2023 N122687
A2419522Certificate of AnalysisNov 24, 2023 N122687
A2419523Certificate of AnalysisNov 24, 2023 N122687
A2419524Certificate of AnalysisNov 24, 2023 N122687
A2419525Certificate of AnalysisNov 24, 2023 N122687
D2323865Certificate of AnalysisAug 29, 2022 N122687
J2226581Certificate of AnalysisAug 29, 2022 N122687
J2226585Certificate of AnalysisAug 29, 2022 N122687

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Propiedades químicas y físicas
SolubilidadSlightly soluble in water; Soluble in Benzene,Chloroform,Ethanol,Ether
Punto de fusión (°C)151-153°C
Peso molecular174.160 g/mol
XLogP31.800
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass174.043 Da
Monoisotopic Mass174.043 Da
Topological Polar Surface Area58.700 Ų
Heavy Atom Count13
Formal Charge0
Complexity202.000
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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