3-Chloro-4-methylaniline - ≥97% , CAS No.95-74-9

CAS: 95-74-9 Cat. No.: C106530 Peso molecular: 141.6 Beilstein Registry Number: 636511 Número EC: 202-446-3
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
D77417 | STR02553 | 3-Chloro-4-methylaniline | 3-chloro-4-toluidine | EINECS 202-446-3 | NSC96620 | NSC-96620 | UNII-32Y306W7BQ | 3-chloro-4-methyl aniline | DRC 1339 | EN300-18377 | Benzenamine, 3-chloro-4-methyl- | MFCD00007773 | 4-AMINO-2-CHLOROTOLUENE
Storage
Store at 2-8°C,Protected from light,Argon charged
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
25g
C106530-25g
3
9,90US$
100g
C106530-100g
3
16,90US$
500g
C106530-500g
1
28,90US$
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Protected from light,Argon charged Ships Wet ice 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

2-Chloro-4-aminotoluene has been used in the preparation of 2-chloro-4-cyanotoluene by Sandmeyer reaction with cuprous cyanide.

Specifications

Sinónimos
D77417 | STR02553 | 3-Chloro-4-methylaniline | 3-chloro-4-toluidine | EINECS 202-446-3 | NSC96620 | NSC-96620 | UNII-32Y306W7BQ | 3-chloro-4-methyl aniline | DRC 1339 | EN300-18377 | Benzenamine, 3-chloro-4-methyl- | MFCD00007773 | 4-AMINO-2-CHLOROTOLUENE
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C, Protected from light, Argon charged
Enviado en
Wet ice
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Pureza
≥97%
Nombres e identificadores
Pubchem Sid504751283
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504751283
Sonrisas canónicasCC1=C(C=C(C=C1)N)Cl
IUPAC Name3-chloro-4-methylaniline
InChIKeyRQKFYFNZSHWXAW-UHFFFAOYSA-N
INCHI1S/C7H8ClN/c1-5-2-3-6(9)4-7(5)8/h2-4H,9H2,1H3
Isómeros SMILES CC1=C(C=C(C=C1)N)Cl
WGK Alemania 2
RTECS XU5111000
Número ONU 2239
Grupo de embalaje III
Peso molecular 141.6
Beilstein 636511
Reaxy-Rn 636511
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=636511&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
SubclassToluenes
Intermediate Tree Nodes Not available
Direct ParentAminotoluenes
Alternative Parents Aniline and substituted anilines  Chlorobenzenes  Aryl chlorides  Primary amines  Organopnictogen compounds  Organochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Aminotoluene - Aniline or substituted anilines - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as aminotoluenes. These are organic aromatic compounds containing a benzene that carries a single methyl group and one amino group.
External Descriptors monochlorobenzenes - chloroaniline
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Ppard Peroxisome proliferator-activated receptor delta (358 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
lef Anthrax lethal factor (7585 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rorc Nuclear receptor ROR-gamma (89407 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Nr1i2 Nuclear receptor subfamily 1 group I member 2 (14 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.

7 results found

Lot NumberCertificate TypeFechaArticulo
J1423027Certificate of AnalysisApr 15, 2026 C106530
J2119216Certificate of AnalysisAug 07, 2025 C106530
J2119219Certificate of AnalysisAug 07, 2025 C106530
J2119224Certificate of AnalysisAug 07, 2025 C106530
J2119247Certificate of AnalysisAug 07, 2025 C106530
J2515292Certificate of AnalysisJul 12, 2024 C106530
J2515293Certificate of AnalysisJul 12, 2024 C106530
Propiedades químicas y físicas
SensibilidadLight sensitive.Air sensitive
Punto de congelación (°C)22 °C
Índice de refracción1.584
Punto de inflamación (°F)212 °F
Punto de inflamación (°C)100 °C
Punto de ebullición (°C)237-238°C
Punto de fusión (°C)25°C
Peso molecular141.600 g/mol
XLogP32.900
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass141.035 Da
Monoisotopic Mass141.035 Da
Topological Polar Surface Area26.000 Ų
Heavy Atom Count9
Formal Charge0
Complexity94.900
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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