1-(4-Chlorophenyl)-3-methyl-1H-pyrazol-5-ylamine - ≥97% , CAS No.40401-39-6

CAS: 40401-39-6 Cat. No.: C469180 Peso molecular: 207.66 Número EC: 254-907-3
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
SMR000354626 | AKOS000117751 | W18881 | 1-(4-Chlorophenyl)-3-methyl-1H-pyrazol-5-ylamine | EINECS 254-907-3 | EN300-09621 | CHEBI:179575 | 1-(4-Chlorophenyl)-3-methyl-1H-pyrazol-& | 2-(4-chlorophenyl)-5-methylpyrazol-3-amine | Chondroitin sulphate e (galn
Storage
Room temperature
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1g
C469180-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

427,90US$

499,90US$
Guardar 72,00 US$ (14.40%)
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Why this grade

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

🌡

Storage & shipping

Room temperature Ships 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
SMR000354626 | AKOS000117751 | W18881 | 1-(4-Chlorophenyl)-3-methyl-1H-pyrazol-5-ylamine | EINECS 254-907-3 | EN300-09621 | CHEBI:179575 | 1-(4-Chlorophenyl)-3-methyl-1H-pyrazol-& | 2-(4-chlorophenyl)-5-methylpyrazol-3-amine | Chondroitin sulphate e (galn
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Room temperature
Pureza
≥97%
Nombres e identificadores
Sonrisas canónicasCC1=NN(C(=C1)N)C2=CC=C(C=C2)Cl
IUPAC Name2-(4-chlorophenyl)-5-methylpyrazol-3-amine
InChIKeyCLORQKXFDBKDCZ-UHFFFAOYSA-N
INCHI1S/C10H10ClN3/c1-7-6-10(12)14(13-7)9-4-2-8(11)3-5-9/h2-6H,12H2,1H3
Isómeros SMILES CC1=NN(C(=C1)N)C2=CC=C(C=C2)Cl
Peso molecular 207.66
Reaxy-Rn 611644
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=611644&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
ClaseAzoles
SubclassPyrazoles
Intermediate Tree Nodes Not available
Direct ParentPhenylpyrazoles
Alternative Parents Chlorobenzenes  Aryl chlorides  Heteroaromatic compounds  Azacyclic compounds  Primary amines  Organopnictogen compounds  Organochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Phenylpyrazole - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azacycle - Organochloride - Organohalogen compound - Primary amine - Amine - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





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Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
Peso molecular207.660 g/mol
XLogP32.600
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass207.056 Da
Monoisotopic Mass207.056 Da
Topological Polar Surface Area43.800 Ų
Heavy Atom Count14
Formal Charge0
Complexity192.000
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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