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· · COA & SDS available for every product · Same-day shipping on in-stock items 4-(2-hydroxyethyl)benzonitrile - ≥98% , CAS No.69395-13-7
Synonyms
A9176 | 2-(4-CYANOPHENYL)ETHAN-1-ONE | 4-cyanophenethyl alcohol | MFCD00052461 | SCHEMBL320278 | CHEBI:194819 | 2-(4-CYANOPHENYL)ETHANOL | BBL102762 | Benzonitrile,4-(2-hydroxyethyl)- | EN300-61341 | Z964982550 | p-cyanophenethylalcohol | FT-0616540 | JMD
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Why this grade ≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships Normal 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.
Overview application：
4-(2-Hydroxyethyl)benzonitrile is used to produce 4-(2-bromo-ethyl)-benzonitrile. It is used as organic intermediate.
Specifications Synonyms
A9176 | 2-(4-CYANOPHENYL)ETHAN-1-ONE | 4-cyanophenethyl alcohol | MFCD00052461 | SCHEMBL320278 | CHEBI:194819 | 2-(4-CYANOPHENYL)ETHANOL | BBL102762 | Benzonitrile,4-(2-hydroxyethyl)- | EN300-61341 | Z964982550 | p-cyanophenethylalcohol | FT-0616540 | JMD
Specifications & Purity
≥98%
Names and Identifiers Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488194045
Canonical Smiles
C1=CC(=CC=C1CCO)C#N
IUPAC Name
4-(2-hydroxyethyl)benzonitrile
InChIKey
RBSJBNYPTGMZIH-UHFFFAOYSA-N
INCHI
1S/C9H9NO/c10-7-9-3-1-8(2-4-9)5-6-11/h1-4,11H,5-6H2
Isomeric SMILES
C1=CC(=CC=C1CCO)C#N
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4307327&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 Kingdom Organic compounds Superclass Benzenoids Class Benzene and substituted derivatives Subclass Benzonitriles Intermediate Tree Nodes Not available Direct Parent Benzonitriles Alternative Parents Nitriles Primary alcohols Organopnictogen compounds Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Benzonitrile - Nitrile - Carbonitrile - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organonitrogen compound - Alcohol - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties x_boil_point_char 116-118°/0.5mm Hg Molecular Weight 147.170 g/mol XLogP3 0.500 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 2 Exact Mass 147.068 Da Monoisotopic Mass 147.068 Da Topological Polar Surface Area 44.000 Ų Heavy Atom Count 11 Formal Charge 0 Complexity 150.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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