3-Hydroxy-4-methoxybenzonitrile - ≥98% , CAS No.52805-46-6

CAS: 52805-46-6 Cat. No.: H184992 Fórmula: C8H7NO2 Peso molecular: 149.1 Número EC: 689-783-3
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
AC-5294 | DTXSID00406725 | BCP26348 | p-Cyanguajacol | Benzonitrile, 3-hydroxy-4-Methoxy-;Gefitinib Impurity | 3-hydroxy-4-methoxybenzonitrile | A7711 | SCHEMBL388024 | AM20050110 | FT-0602138 | MB02393 | MFCD02258854 | BENZONITRILE, 3-HYDROXY-4-METHOXY-
Storage
Room temperature
Shipped In
Normal
★
Size
Alemania (EU)
USA*
Price
Qty
5g
H184992-5g
—
3 Disponible

8,59€

12,93€
Guardar 4,34 € (33.56%)
25g
H184992-25g
—
7 Disponible

12,93€

19,87€
Guardar 6,94 € (34.93%)
100g
H184992-100g
—
4 Disponible

51,11€

77,14€
Guardar 26,03 € (33.75%)
Enter a quantity for the sizes you want to add.
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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
AC-5294 | DTXSID00406725 | BCP26348 | p-Cyanguajacol | Benzonitrile, 3-hydroxy-4-Methoxy-;Gefitinib Impurity | 3-hydroxy-4-methoxybenzonitrile | A7711 | SCHEMBL388024 | AM20050110 | FT-0602138 | MB02393 | MFCD02258854 | BENZONITRILE, 3-HYDROXY-4-METHOXY-
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥98%
Nombres e identificadores
Pubchem Sid488195021
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488195021
Sonrisas canónicasCOC1=C(C=C(C=C1)C#N)O
IUPAC Name3-hydroxy-4-methoxybenzonitrile
InChIKeyASQHIJLQYYFUDN-UHFFFAOYSA-N
INCHI1S/C8H7NO2/c1-11-8-3-2-6(5-9)4-7(8)10/h2-4,10H,1H3
Isómeros SMILES COC1=C(C=C(C=C1)C#N)O
Peso molecular 149.1
Reaxy-Rn 2937006
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2937006&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
ClasePhenols
SubclassMethoxyphenols
Intermediate Tree Nodes Not available
Direct ParentMethoxyphenols
Alternative Parents Phenoxy compounds  Methoxybenzenes  Benzonitriles  Anisoles  Alkyl aryl ethers  1-hydroxy-4-unsubstituted benzenoids  1-hydroxy-2-unsubstituted benzenoids  Nitriles  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Methoxyphenol - Phenoxy compound - Anisole - Benzonitrile - Methoxybenzene - Phenol ether - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Ether - Nitrile - Carbonitrile - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Cyanide - Organic oxygen compound - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as methoxyphenols. These are compounds containing a methoxy group attached to the benzene ring of a phenol moiety.
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.

8 results found

Lot NumberCertificate TypeFechaArticulo
D23142379Certificate of AnalysisJan 21, 2026 H184992
L2201240Certificate of AnalysisSep 09, 2025 H184992
L2201243Certificate of AnalysisSep 09, 2025 H184992
L2201244Certificate of AnalysisSep 09, 2025 H184992
L2201255Certificate of AnalysisSep 09, 2025 H184992
J2116302Certificate of AnalysisJul 12, 2024 H184992
J2116303Certificate of AnalysisJul 12, 2024 H184992
J2116304Certificate of AnalysisJul 12, 2024 H184992
Propiedades químicas y físicas
Peso molecular149.150 g/mol
XLogP31.200
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass149.048 Da
Monoisotopic Mass149.048 Da
Topological Polar Surface Area53.300 Ų
Heavy Atom Count11
Formal Charge0
Complexity172.000
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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