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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items (2E)-4-hydroxy-3-methylbut-2-en-1-yl trihydrogen diphosphate , CAS No.E668901
Synonyms
CHEBI:15664 | (2E)-4-hydroxy-3-methylbut-2-en-1-yl trihydrogen diphosphate | HMBPP | 1-Hydroxy-2-methyl-2-butenyl 4-diphosphate | (E)-4-Hydroxy-3-methyl-but-2-enyl diphosphate | (E)-4-Hydroxy-3-methylbut-2-enyl diphosphate | (2E)-4-hydroxy-3-methylbut-2-e
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Why this grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships 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 Sinónimos
CHEBI:15664 | (2E)-4-hydroxy-3-methylbut-2-en-1-yl trihydrogen diphosphate | HMBPP | 1-Hydroxy-2-methyl-2-butenyl 4-diphosphate | (E)-4-Hydroxy-3-methyl-but-2-enyl diphosphate | (E)-4-Hydroxy-3-methylbut-2-enyl diphosphate | (2E)-4-hydroxy-3-methylbut-2-e
Condiciones de almacenamiento de almacenamiento
Room temperature
Propiedades del producto Nombres e identificadores Sonrisas canónicas CC(=CCOP(=O)(O)OP(=O)(O)O)CO IUPAC Name [(E)-4-hydroxy-3-methylbut-2-enyl] phosphono hydrogen phosphate InChIKey MDSIZRKJVDMQOQ-GORDUTHDSA-N INCHI 1S/C5H12O8P2/c1-5(4-6)2-3-12-15(10,11)13-14(7,8)9/h2,6H,3-4H2,1H3,(H,10,11)(H2,7,8,9)/b5-2+ Isómeros SMILES C/C(=C\COP(=O)(O)OP(=O)(O)O)/CO Peso molecular 262.089 Reaxy-Rn 9060574 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9060574&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 Isoprenoid phosphates Intermediate Tree Nodes Not available Direct Parent Isoprenoid phosphates Alternative Parents Organic pyrophosphates Monoalkyl phosphates Primary alcohols Organic oxides Hydrocarbon derivatives Molecular Framework Aliphatic acyclic compounds Substituents Organic pyrophosphate - Isoprenoid phosphate - Monoalkyl phosphate - Alkyl phosphate - Phosphoric acid ester - Organic phosphoric acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aliphatic acyclic compound Descripción This compound belongs to the class of organic compounds known as isoprenoid phosphates. These are prenol lipids containing a phosphate group linked to an isoprene (2-methylbuta-1,3-diene) unit. External Descriptors C5 isoprenoids (hemiterpenes) 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 Peso molecular 262.089 g/mol XLogP3 -2.400 Hydrogen Bond Donor Count 4 Hydrogen Bond Acceptor Count 8 Rotatable Bond Count 6 Exact Mass 262.001 Da Monoisotopic Mass 262.001 Da Topological Polar Surface Area 134.000 Ų Heavy Atom Count 15 Formal Charge 0 Complexity 317.000 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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