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340,000+ productos de investigación · Triple ISO certified · COA & SDS Disponible para cada producto · Envío el mismo día para artículos en stock Propyl phenylacetate - Standard for GC, ≥99.5%(GC) , CAS No.106-36-5
GRADE & PURITY Standard for GC ? GC reference standard — characterized compound for calibrating GC methods. Use to build calibration curves and verify GC quantitation. ≥99.5%(GC) Synonyms
NSC 72022 | Tox21_301107 | n-Propyl propanoate | Propyl ester of propanoic acid | Propanoic acid, propyl ester | Propyl-propanoate | MFCD00009373 | n-Propylpropropionate | UNII-G09TRV00GK | FT-0631593 | MCSINKKTEDDPNK-UHFFFAOYSA-N | AMY21939 | chlorhexidi
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Why this grade Standard for GC, ≥99.5%(GC) Standard for GC 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 5 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Sinónimos
NSC 72022 | Tox21_301107 | n-Propyl propanoate | Propyl ester of propanoic acid | Propanoic acid, propyl ester | Propyl-propanoate | MFCD00009373 | n-Propylpropropionate | UNII-G09TRV00GK | FT-0631593 | MCSINKKTEDDPNK-UHFFFAOYSA-N | AMY21939 | chlorhexidi
Especificaciones y pureza
Standard for GC, ≥99.5%(GC)
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Sonrisas canónicas
CCCOC(=O)CC
IUPAC Name
propyl propanoate
InChIKey
MCSINKKTEDDPNK-UHFFFAOYSA-N
INCHI
1S/C6H12O2/c1-3-5-8-6(7)4-2/h3-5H2,1-2H3
Isómeros SMILES
CCCOC(=O)CC
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1699993&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 Organic acids and derivatives Clase Carboxylic acids and derivatives Subclass Carboxylic acid derivatives Intermediate Tree Nodes Not available Direct Parent Carboxylic acid esters Alternative Parents Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aliphatic acyclic compounds Substituents Carboxylic acid ester - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound Descripción This compound belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group). External Descriptors Wax monoesters 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 Índice de refracción 1.3935 Punto de inflamación (°F) 66.2 °F Punto de inflamación (°C) 19℃ Punto de ebullición (°C) 122-124°C Punto de fusión (°C) -76°C Peso molecular 116.160 g/mol XLogP3 1.700 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 4 Exact Mass 116.084 Da Monoisotopic Mass 116.084 Da Topological Polar Surface Area 26.300 Ų Heavy Atom Count 8 Formal Charge 0 Complexity 68.900 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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