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cloruro de 2-nitrobencil - ≥98%(GC) , CAS No.612-23-7

CAS: 612-23-7 Cat. No.: N139079 Peso molecular: 171.58 Beilstein Registry Number: 388396 Número EC: 210-300-5
COA
cloruro de 2-nitrobencil - ≥98%(GC) CAS No(612-23-7) by Aladdin Scientific
Disponible para pedir
GRADE & PURITY ≥98%(GC)
Synonyms
cloruro de 2-nitrobencil | Cloruro de 2-nitrobencil | CCRIS 2323 | Cloruro de 2-nitrobencil | SMR001372019 | A24708 | AM20040856 | CLORURO DE O-NITROBENCIL | CK2309 | EN300-41224 | N0182 | EINECS 210-300-5 | 1-Nitro-2-(clorometil)benceno | HMS3039H12 | .a
Storage
Argon charged,Room temperature
Shipped In
FedEx DG Service
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 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1g
N139079-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

11,90US$

15,90US$
Guardar 4,00 US$ (25.16%)
5g
N139079-5g
1

41,90US$

60,90US$
Guardar 19,00 US$ (31.20%)
25g
N139079-25g
2
171,90US$
100g
N139079-100g
2
615,90US$
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SDS
Safety data
COA
Certificate
DS
Datasheet
SP
Spec sheet
Descripción general Specifications Nombres e identificadores Documentation Advanced Data Taxonomic Classification Estructura 3D Objetivos asociados (humanos) Objetivos asociados (no humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Preguntas frecuentes y artículos Calculadoras de soluciones Reseñas
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Why this grade

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

🌡

Storage & shipping

Argon charged,Room temperature Ships FedEx DG Service 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.

Descripción general

el cloruro de 2-nitrobencil se utilizó en la síntesis de S-(2-nitrobencil)cisteína que se insertó en la eritropoyetina humana y se utilizó para preparar 4,4′-dinitrostilbeno.

Specifications

Sinónimos
cloruro de 2-nitrobencil | Cloruro de 2-nitrobencil | CCRIS 2323 | Cloruro de 2-nitrobencil | SMR001372019 | A24708 | AM20040856 | CLORURO DE O-NITROBENCIL | CK2309 | EN300-41224 | N0182 | EINECS 210-300-5 | 1-Nitro-2-(clorometil)benceno | HMS3039H12 | .a
Especificaciones y pureza
≥98%(GC)
Mecanismos bioquímicos y fisiológicos
Reacciona con N-metildietanolamina y la reacción posterior del diol cuaternario resultante con cloruro de tionilo a temperatura ambiente produce sales cuaternarias de nitrobencil-mostaza.
Condiciones de almacenamiento de almacenamiento
Argon charged, Room temperature
Enviado en
FedEx DG Service
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Pureza
≥98%(GC)
Nombres e identificadores
Pubchem Sid504752222
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504752222
Sonrisas canónicasC1=CC=C(C(=C1)CCl)[N+](=O)[O-]
IUPAC Name1-(chloromethyl)-2-nitrobenzene
InChIKeyBXCBUWKTXLWPSB-UHFFFAOYSA-N
INCHI1S/C7H6ClNO2/c8-5-6-3-1-2-4-7(6)9(10)11/h1-4H,5H2
Isómeros SMILES C1=CC=C(C(=C1)CCl)[N+](=O)[O-]
WGK Alemania 3
RTECS XS9092000
Número ONU 3261
Grupo de embalaje I
Peso molecular 171.58
Beilstein 388396
Reaxy-Rn 388396
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=388396&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
ClaseBenzene and substituted derivatives
SubclassNitrobenzenes
Intermediate Tree Nodes Not available
Direct ParentNitrobenzenes
Alternative Parents Nitroaromatic compounds  Benzyl chlorides  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Organopnictogen compounds  Organonitrogen compounds  Organochlorides  Organic oxides  Hydrocarbon derivatives  Alkyl chlorides  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Nitrobenzene - Nitroaromatic compound - Benzyl halide - Benzyl chloride - C-nitro compound - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organopnictogen compound - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic homomonocyclic compound
DescripciónThis 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 Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
KCNH2 Tclin HERG (29587 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Lymphoblastoid cell (5959 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Plasmodium falciparum (966862 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
EMT6 (738 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Txnrd1 Thioredoxin reductase 1, cytoplasmic (45279 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TGR Thioredoxin glutathione reductase (28579 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rorc Nuclear receptor ROR-gamma (89407 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
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.

8 results found

Lot NumberCertificate TypeFechaArticulo
D2601013Certificate of AnalysisApr 09, 2026 N139079
G2310204Certificate of AnalysisApr 08, 2025 N139079
G2310215Certificate of AnalysisApr 08, 2025 N139079
G2310240Certificate of AnalysisApr 08, 2025 N139079
G2310249Certificate of AnalysisApr 08, 2025 N139079
D1910136Certificate of AnalysisSep 14, 2024 N139079
L2110234Certificate of AnalysisSep 21, 2023 N139079
K2124452Certificate of AnalysisSep 11, 2023 N139079
Propiedades químicas y físicas
SolubilidadSoluble in acetone, alcohol benzene, diethyl ether, and ethanol (98%). Insoluble in water.
SensibilidadHygroscopic
Punto de inflamación (°F)233.6 °F
Punto de inflamación (°C)112 °C
Punto de ebullición (°C)133 °C/10 mmHg
Punto de fusión (°C)49 °C
Peso molecular171.580 g/mol
XLogP32.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass171.009 Da
Monoisotopic Mass171.009 Da
Topological Polar Surface Area45.800 Ų
Heavy Atom Count11
Formal Charge0
Complexity146.000
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
Preguntas frecuentes y artículos
Quinoline vs Isoquinoline: How “Where the Nitrogen Sits” Changes Reactivity and Applications
Categories: Technical articles
Tags:
Drug discovery Materials chemistry Quinoline Isoquinoline N-heteroaromatics
Calculadoras de soluciones
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