3,5-dichloro-4-hydroxy-benzonitrile - ≥97% , CAS No.1891-95-8

CAS: 1891-95-8 Cat. No.: D630934 Peso molecular: 188.01 Beilstein Registry Number: 1949990 Número EC: 217-572-4 PubChem CID: 74685
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
Citrate (Triammonium) | GI6X21WSVN | 1-N-Butyl-2-Pyrrolidone | 3,5-Dichloro-4-hydroxybenzonitrile | 3,5-Dichloro-4-hydroxy-benzonitrile | Benzonitrile, 3,5-dichloro-4-hydroxy- | Chloroxynil | Q27279113 | SCHEMBL136860 | AC-23657 | Caswell No. 309A | FT-06
Storage
Store at 2-8°C
Shipped In
Wet ice
Size
Estado
Price
Qty
250mg
D630934-250mg
2

28,90US$

43,90US$
Guardar 15,00 US$ (34.17%)
1g
D630934-1g
2

48,90US$

73,90US$
Guardar 25,00 US$ (33.83%)
5g
D630934-5g
1

137,90US$

206,90US$
Guardar 69,00 US$ (33.35%)
Enter a quantity for the sizes you want to add.
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Why this grade

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

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Storage & shipping

Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Descripción general

Chloroxynil is a benzonitrile herbicide, whose mode of action involves the inhibition of electron transfer in photosystem II receptor site

Specifications

Sinónimos
Citrate (Triammonium) | GI6X21WSVN | 1-N-Butyl-2-Pyrrolidone | 3, 5-Dichloro-4-hydroxybenzonitrile | 3, 5-Dichloro-4-hydroxy-benzonitrile | Benzonitrile, 3, 5-dichloro-4-hydroxy- | Chloroxynil | Q27279113 | SCHEMBL136860 | AC-23657 | Caswell No. 309A | FT-06
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C
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 Sid528757979
Sonrisas canónicasC1=C(C=C(C(=C1Cl)O)Cl)C#N
IUPAC Name3,5-dichloro-4-hydroxybenzonitrile
InChIKeyYRSSHOVRSMQULE-UHFFFAOYSA-N
INCHI1S/C7H3Cl2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H
Isómeros SMILES C1=C(C=C(C(=C1Cl)O)Cl)C#N
WGK Alemania 3
CAS alternativo 1891-95-8
PubChem CID 74685
Número ONU 2811
Términos de entrada MeSH 3,5-dichloro-4-hydroxybenzonitrile;chloroxynil
Peso molecular 188.01
Beilstein 1949990

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
SubclassHalobenzenes
Intermediate Tree Nodes Chlorobenzenes
Direct ParentDichlorobenzenes
Alternative Parents O-chlorophenols  Benzonitriles  Aryl chlorides  Nitriles  Organopnictogen compounds  Organooxygen compounds  Organochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Benzonitrile - 1,3-dichlorobenzene - 2-halophenol - 2-chlorophenol - Phenol - Aryl halide - Aryl chloride - Nitrile - Carbonitrile - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





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.

6 results found

Lot NumberCertificate TypeFechaArticulo
F2513326Certificate of AnalysisApr 18, 2025 D630934
F2513327Certificate of AnalysisApr 18, 2025 D630934
F2513392Certificate of AnalysisApr 18, 2025 D630934
F2513393Certificate of AnalysisApr 18, 2025 D630934
F2513395Certificate of AnalysisApr 18, 2025 D630934
F2513396Certificate of AnalysisApr 18, 2025 D630934
Propiedades químicas y físicas
SolubilidadSlightly soluble in water.
Punto de fusión (°C)138-142°C
Peso molecular188.010 g/mol
XLogP32.800
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass186.959 Da
Monoisotopic Mass186.959 Da
Topological Polar Surface Area44.000 Ų
Heavy Atom Count11
Formal Charge0
Complexity176.000
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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