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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items β-Ionone - ≥97% , CAS No.14901-07-6
Synonyms
beta-Jonone | 4-(2,6,6-Trimethyl-1(or 2)-cyclohexen-1-yl)-3-buten-2-one | beta-Ionon | beta-Ionone, 96% | DTXSID4021769 | F0451-1336 | NCGC00256534-01 | trans-4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-one | DTXCID901769 | AM806748 | NCGC00248145-02
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Why this grade ≥97% 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 37 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Sinónimos
beta-Jonone | 4-(2,6,6-Trimethyl-1(or 2)-cyclohexen-1-yl)-3-buten-2-one | beta-Ionon | beta-Ionone, 96% | DTXSID4021769 | F0451-1336 | NCGC00256534-01 | trans-4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-one | DTXCID901769 | AM806748 | NCGC00248145-02
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C
Enviado en
Wet ice
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Nombres e identificadores Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504759646
Sonrisas canónicas
CC1=C(C(CCC1)(C)C)C=CC(=O)C
IUPAC Name
(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one
InChIKey
PSQYTAPXSHCGMF-BQYQJAHWSA-N
INCHI
1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8H,5-6,9H2,1-4H3/b8-7+
Isómeros SMILES
CC1=C(C(CCC1)(C)C)/C=C/C(=O)C
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1909544&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 Lipids and lipid-like molecules Clase Prenol lipids Subclass Sesquiterpenoids Intermediate Tree Nodes Not available Direct Parent Sesquiterpenoids Alternative Parents Enones Acryloyl compounds Ketones Organic oxides Hydrocarbon derivatives Molecular Framework Aliphatic homomonocyclic compounds Substituents Cyclofarsesane sesquiterpenoid - Megastigmane sesquiterpenoid - Sesquiterpenoid - Ionone derivative - Alpha,beta-unsaturated ketone - Enone - Acryloyl-group - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units. External Descriptors ionone 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 Objetivos asociados (humanos) Objetivos asociados (no humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Solubilidad Soluble in water (0.11 mg/mI at 20°C). Sensibilidad Light sensitive. Índice de refracción 1.519-1.5215 Punto de inflamación (°F) >235.4 °F Punto de inflamación (°C) 122 °C Punto de ebullición (°C) 126-128°C Peso molecular 192.300 g/mol XLogP3 2.900 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 2 Exact Mass 192.151 Da Monoisotopic Mass 192.151 Da Topological Polar Surface Area 17.100 Ų Heavy Atom Count 14 Formal Charge 0 Complexity 292.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 1 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 1 Covalently-Bonded Unit Count 1
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