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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items Cinamato de isobutilo - ≥99% , CAS No.122-67-8
Synonyms
DTXCID0027646 | UNII-4NCI0MR7KP | AI3-02384 | IQZUZPKOFSOVET-CMDGGOBGSA-N | Isobutyl cinnamate, >=98% | Q27260243 | 2-methylpropyl (2E)-3-phenylprop-2-enoate | AKOS025310762 | FEMA No. 2193 | Isobutyl 3-phenylacrylate | 2-Methylpropyl 3-phenyl-2-propenoat
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Why this grade ≥99% 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Sinónimos
DTXCID0027646 | UNII-4NCI0MR7KP | AI3-02384 | IQZUZPKOFSOVET-CMDGGOBGSA-N | Isobutyl cinnamate, >=98% | Q27260243 | 2-methylpropyl (2E)-3-phenylprop-2-enoate | AKOS025310762 | FEMA No. 2193 | Isobutyl 3-phenylacrylate | 2-Methylpropyl 3-phenyl-2-propenoat
Especificaciones y pureza
≥99%
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Pubchem Sid 488191467 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488191467 Sonrisas canónicas CC(C)COC(=O)C=CC1=CC=CC=C1 IUPAC Name 2-methylpropyl (E)-3-phenylprop-2-enoate InChIKey IQZUZPKOFSOVET-CMDGGOBGSA-N INCHI 1S/C13H16O2/c1-11(2)10-15-13(14)9-8-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3/b9-8+ Isómeros SMILES CC(C)COC(=O)/C=C/C1=CC=CC=C1 WGK Alemania 2 RTECS GD9550000 Peso molecular 204.26 Reaxy-Rn 2442477 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2442477&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 Cinnamic acids and derivatives Subclass Cinnamic acid esters Intermediate Tree Nodes Not available Direct Parent Cinnamic acid esters Alternative Parents Styrenes Fatty acid esters Enoate esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic homomonocyclic compounds Substituents Cinnamic acid ester - Styrene - Fatty acid ester - Monocyclic benzene moiety - Benzenoid - Fatty acyl - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Carbonyl group - Aromatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic 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 Objetivos asociados (no humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Índice de refracción 1.54 Punto de inflamación (°F) 113 °C Punto de inflamación (°C) 113°C Punto de ebullición (°C) 287°C Peso molecular 204.260 g/mol XLogP3 4.000 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 5 Exact Mass 204.115 Da Monoisotopic Mass 204.115 Da Topological Polar Surface Area 26.300 Ų Heavy Atom Count 15 Formal Charge 0 Complexity 213.000 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
Citations of This Product Referencias 1. Yixin Yang, Peige Qin, Xiaoting Zhang, Jiahua Niu, Shufang Tian, Minghua Lu, Jinhua Zhu, Zongwei Cai. (2017) Layer-by-layer fabrication of g-C3N4 coating for headspace solid-phase microextraction of food additives followed by gas chromatography-flame ionization detection. Analytical Methods, 10 (3): (322-329). [PMID: [10.1039/C7AY02515G ]
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