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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 3-(4-Cyanophenyl)propionic acid - ≥97% , CAS No.42287-94-5
Synonyms
F9995-1104 | A825838 | DS-13665 | 3-(4-cyanophenyl)propionic acid | 3-(4-cyano-phenyl)propionic Acid | 3-(4-Cyano-phenyl)-propionic acid | 3-(4-cyanophenyl)-propionic acid | AB01329844-02 | STL302069 | EN300-24305 | Benzenethiol, 2-amino-4-(trifluoromethy
Storage
Room temperature,Argon charged
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Why this grade ≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature,Argon charged 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.
Specifications Sinónimos
F9995-1104 | A825838 | DS-13665 | 3-(4-cyanophenyl)propionic acid | 3-(4-cyano-phenyl)propionic Acid | 3-(4-Cyano-phenyl)-propionic acid | 3-(4-cyanophenyl)-propionic acid | AB01329844-02 | STL302069 | EN300-24305 | Benzenethiol, 2-amino-4-(trifluoromethy
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Room temperature,Argon charged
Nombres e identificadores Pubchem Sid 528758162 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/528758162 Sonrisas canónicas C1=CC(=CC=C1CCC(=O)O)C#N IUPAC Name 3-(4-cyanophenyl)propanoic acid InChIKey RHIGOXBTMPLABF-UHFFFAOYSA-N INCHI 1S/C10H9NO2/c11-7-9-3-1-8(2-4-9)5-6-10(12)13/h1-4H,5-6H2,(H,12,13) Isómeros SMILES C1=CC(=CC=C1CCC(=O)O)C#N Peso molecular 175.18 Reaxy-Rn 2366880 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2366880&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 Phenylpropanoids and polyketides Clase Phenylpropanoic acids Subclass Not available Intermediate Tree Nodes Not available Direct Parent Phenylpropanoic acids Alternative Parents Benzonitriles Nitriles Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic homomonocyclic compounds Substituents 3-phenylpropanoic-acid - Benzonitrile - Monocyclic benzene moiety - Benzenoid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Carbonyl group - Organic oxygen compound - Aromatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid. 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.
Estructura 3D Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Sensibilidad Air & Heat & Moisture sensitive Punto de fusión (°C) 138-143 °C Peso molecular 175.180 g/mol XLogP3 1.200 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 3 Exact Mass 175.063 Da Monoisotopic Mass 175.063 Da Topological Polar Surface Area 61.100 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 220.000 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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