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· · COA & SDS Disponible para cada producto · Envío el mismo día para artículos en stock 4-lsopropyltoluene - analytical standard, ≥99.5%(GC) , CAS No.99-87-6
GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods. ≥99.5%(GC) Synonyms
p-Mentha-1,3,5-triene | 1-Isopropyl-4-methylbenzene | 1-isopropyl-4-methyl-Benzene | Benzene, 1-isopropyl-4-methyl- | MML | p-Isopropylmethylbenzene | 2-p-Tolylpropane | EINECS 202-796-7 | p-Cymene [UN2046] [Flammable liquid] | s5598 | benzene, 1-methyl-
Shipped In
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Why this grade analytical standard, ≥99.5%(GC) Analytical standard for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships FedEx DG Service 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 30 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Sinónimos
p-Mentha-1,3,5-triene | 1-Isopropyl-4-methylbenzene | 1-isopropyl-4-methyl-Benzene | Benzene, 1-isopropyl-4-methyl- | MML | p-Isopropylmethylbenzene | 2-p-Tolylpropane | EINECS 202-796-7 | p-Cymene [UN2046] [Flammable liquid] | s5598 | benzene, 1-methyl-
Especificaciones y pureza
analytical standard, ≥99.5%(GC)
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
FedEx DG Service
Nombres e identificadores Sonrisas canónicas
CC1=CC=C(C=C1)C(C)C
IUPAC Name
1-methyl-4-propan-2-ylbenzene
InChIKey
HFPZCAJZSCWRBC-UHFFFAOYSA-N
INCHI
1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H3
Isómeros SMILES
CC1=CC=C(C=C1)C(C)C
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1903377&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 Monoterpenoids Intermediate Tree Nodes Not available Direct Parent Aromatic monoterpenoids Alternative Parents Monocyclic monoterpenoids Phenylpropanes Cumenes Toluenes Aromatic hydrocarbons Unsaturated hydrocarbons Molecular Framework Aromatic homomonocyclic compounds Substituents Monocyclic monoterpenoid - Aromatic monoterpenoid - P-cymene - Phenylpropane - Cumene - Toluene - Benzenoid - Monocyclic benzene moiety - Aromatic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring. External Descriptors a monoterpenoid 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 1.49 Punto de inflamación (°C) 47°C Punto de ebullición (°C) 177.1°C Punto de fusión (°C) -67.94°C Peso molecular 134.220 g/mol XLogP3 4.100 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 0 Rotatable Bond Count 1 Exact Mass 134.11 Da Monoisotopic Mass 134.11 Da Topological Polar Surface Area 0.000 Ų Heavy Atom Count 10 Formal Charge 0 Complexity 86.200 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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