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· · COA & SDS Disponible para cada producto · Envío el mismo día para artículos en stock 3,5-Dimethyl-3-hexanol - ≥98% , CAS No.4209-91-0
Synonyms
NSC 95422 | 3,5-Dimethyl-3-hexanol | D1971 | 3-Hexanol, 3,5-dimethyl- | DTXSID10871288 | EINECS 224-136-7 | AKOS009157077 | MFCD00021823 | 3-Hexanol, 3,5-dimethyl-, (.+/-.)- | SCHEMBL543718 | INMGJWCKWKKMPN-UHFFFAOYSA-N | SY048950 | 3,5-Dimethylhexan-3-ol
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Why this grade ≥98% 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Sinónimos
NSC 95422 | 3,5-Dimethyl-3-hexanol | D1971 | 3-Hexanol, 3,5-dimethyl- | DTXSID10871288 | EINECS 224-136-7 | AKOS009157077 | MFCD00021823 | 3-Hexanol, 3,5-dimethyl-, (.+/-.)- | SCHEMBL543718 | INMGJWCKWKKMPN-UHFFFAOYSA-N | SY048950 | 3,5-Dimethylhexan-3-ol
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Sonrisas canónicas
CCC(C)(CC(C)C)O
IUPAC Name
3,5-dimethylhexan-3-ol
InChIKey
INMGJWCKWKKMPN-UHFFFAOYSA-N
INCHI
1S/C8H18O/c1-5-8(4,9)6-7(2)3/h7,9H,5-6H2,1-4H3
Isómeros SMILES
CCC(C)(CC(C)C)O
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1719265&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 oxygen compounds Clase Organooxygen compounds Subclass Alcohols and polyols Intermediate Tree Nodes Not available Direct Parent Tertiary alcohols Alternative Parents Hydrocarbon derivatives Molecular Framework Aliphatic acyclic compounds Substituents Tertiary alcohol - Hydrocarbon derivative - Aliphatic acyclic compound Descripción This compound belongs to the class of organic compounds known as tertiary alcohols. These are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ). 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 Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Punto de inflamación (°C) 57 °C Punto de ebullición (°C) 63°C/21.8mmHg Peso molecular 130.229 g/mol XLogP3 2.400 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 3 Exact Mass 130.136 Da Monoisotopic Mass 130.136 Da Topological Polar Surface Area 20.200 Ų Heavy Atom Count 9 Formal Charge 0 Complexity 78.600 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 1 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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