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· · COA & SDS Disponibile per ogni prodotto · Spedizione lo stesso giorno su articoli in magazzino 3-Indoleacetonitrile - ≥96% , CAS No.771-51-7
Synonyms
3-(Cianometil)indolo | Indolilacetonitril | 3-Indolacetonitrile | 2-(1H-indol-3-il)acetonitrile | Indolo-3-acetonitrile | 1H-Indolo-3-acetonitrile | Indoleacetonitrile | 3-Indolacetonitrile | 3-Indolilacetonitrile | Indolilacetonitrile
Storage
Conservare a 2-8°C
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Why this grade ≥96% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Conservare a 2-8°C Ships Ghiaccio umido 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 Sinonimi
3-(Cianometil)indolo | Indolilacetonitril | 3-Indolacetonitrile | 2-(1H-indol-3-il)acetonitrile | Indolo-3-acetonitrile | 1H-Indolo-3-acetonitrile | Indoleacetonitrile | 3-Indolacetonitrile | 3-Indolilacetonitrile | Indolilacetonitrile
Condizioni di conservazione di stoccaggio
Conservare a 2-8°C
Nomi e identificatori Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504758565
Sorrisi canonici
C1=CC=C2C(=C1)C(=CN2)CC#N
IUPAC Name
2-(1H-indol-3-yl)acetonitrile
InChIKey
DMCPFOBLJMLSNX-UHFFFAOYSA-N
INCHI
1S/C10H8N2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5H2
Isomeri SMILES
C1=CC=C2C(=C1)C(=CN2)CC#N
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=125488&ln=
Documentazione 📋 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 Organoheterocyclic compounds Classe Indoles and derivatives Subclass Indoles Intermediate Tree Nodes Not available Direct Parent 3-alkylindoles Alternative Parents Substituted pyrroles Benzenoids Heteroaromatic compounds Nitriles Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents 3-alkylindole - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Azacycle - Nitrile - Carbonitrile - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound Descrizione This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position. External Descriptors a small molecule 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.
Struttura 3D Obiettivi associati (umani) Obiettivi associati (non umani) Meccanismi d'azione Certificati (CoA, COO, BSE/TSE e tabella di analisi) Proprietà chimiche e fisiche Solubilità Soluble in Methanol Punto di infiammabilità (°F) 233.6 °F Punto di infiammabilità (°C) 112 °C Punto di fusione (°C) 37°C Peso molecolare 156.180 g/mol XLogP3 1.600 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 1 Exact Mass 156.069 Da Monoisotopic Mass 156.069 Da Topological Polar Surface Area 39.600 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 203.000 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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