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· · COA & SDS available for every product · Same-day shipping on in-stock items 2-Cyanoacetanilide - ≥98%(HPLC) , CAS No.621-03-4
Synonyms
DTXSID0060727 | phenylcarbamoyl-acetonitrile | 2-Cyano-N-phenylacetamide | 2-cyano-N-phenyl-acetamide | HMS545P13 | Z56813510 | N-Phenylcyanoacetamide | SY043058 | C2894 | 2-Cyanoacetanilide | 2-cyano-acetanilide | 7EXD3TBU3Z | BB 0218356 | 2-Cycno-N-phen
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Why this grade ≥98%(HPLC) 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.
Specifications Synonyms
DTXSID0060727 | phenylcarbamoyl-acetonitrile | 2-Cyano-N-phenylacetamide | 2-cyano-N-phenyl-acetamide | HMS545P13 | Z56813510 | N-Phenylcyanoacetamide | SY043058 | C2894 | 2-Cyanoacetanilide | 2-cyano-acetanilide | 7EXD3TBU3Z | BB 0218356 | 2-Cycno-N-phen
Specifications & Purity
≥98%(HPLC)
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504754361
Canonical Smiles
C1=CC=C(C=C1)NC(=O)CC#N
IUPAC Name
2-cyano-N-phenylacetamide
InChIKey
XCTQPMCULSZKLT-UHFFFAOYSA-N
INCHI
1S/C9H8N2O/c10-7-6-9(12)11-8-4-2-1-3-5-8/h1-5H,6H2,(H,11,12)
Isomeric SMILES
C1=CC=C(C=C1)NC(=O)CC#N
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1101671&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 Anilides Intermediate Tree Nodes Not available Direct Parent Anilides Alternative Parents N-arylamides Secondary carboxylic acid amides Nitriles Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic homomonocyclic compounds Substituents Anilide - N-arylamide - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Carbonitrile - Nitrile - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as anilides. These are organic heterocyclic compounds derived from oxoacids RkE(=O)l(OH)m (l not 0) by replacing an OH group by the NHPh group or derivative formed by ring substitution. 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(Human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties x_melt_point_char 200 °C Molecular Weight 160.170 g/mol XLogP3 1.600 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 2 Exact Mass 160.064 Da Monoisotopic Mass 160.064 Da Topological Polar Surface Area 52.900 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 198.000 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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