3-Hydroxy-3-methylhexanoic acid - ≥97% , CAS No.58888-76-9

CAS: 58888-76-9 Cat. No.: H194091 Summenformel: C7H14O3 Molekulargewicht: 146.18 EG-Nummer: 674-946-3
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GRADE & PURITY ≥97%
Synonyms
DS-16885 | AKOS011681277 | A869330 | MFCD07779366 | 3-hydroxy-3-methylcaproic acid | 3-Hydroxy-3-methylhexanoic acid | 3-hydroxy-3-methyl-hexanoic acid | 3-Methyl-3-hydroxyhexanoic acid;Hexanoic acid, 3-hydroxy-3-methyl- | 3-Methyl-3-hydroxyhexanoic acid
Storage
Room temperature
Shipped In
Normal
★
Size
Deutschland (EU)
USA*
Price
Qty
25mg
H194091-25mg
Auf Bestellung · 8–12 Wochen

8,59€

12,93€
Speichern 4,34 € (33.56%)
100mg
H194091-100mg
—
4 Auf Lager
23,34€
250mg
H194091-250mg
Auf Bestellung · 8–12 Wochen
43,30€
1g
H194091-1g
Auf Bestellung · 8–12 Wochen
109,25€
5g
H194091-5g
Auf Bestellung · 8–12 Wochen
570,02€
Enter a quantity for the sizes you want to add.
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyme
DS-16885 | AKOS011681277 | A869330 | MFCD07779366 | 3-hydroxy-3-methylcaproic acid | 3-Hydroxy-3-methylhexanoic acid | 3-hydroxy-3-methyl-hexanoic acid | 3-Methyl-3-hydroxyhexanoic acid;Hexanoic acid, 3-hydroxy-3-methyl- | 3-Methyl-3-hydroxyhexanoic acid
Spezifikationen & Reinheit
≥97%
Storage
Room temperature
Verschickt in
Normal
Reinheit
≥97%
Namen und Kennungen
Pubchem Sid528759190
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/528759190
Kanonisches LächelnCCCC(C)(CC(=O)O)O
IUPAC Name3-hydroxy-3-methylhexanoic acid
InChIKeyRGRNSTGIHROKJB-UHFFFAOYSA-N
INCHI1S/C7H14O3/c1-3-4-7(2,10)5-6(8)9/h10H,3-5H2,1-2H3,(H,8,9)
Isomere SMILES CCCC(C)(CC(=O)O)O
Molekulargewicht 146.18
Reaxy-Rn 1755605
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1755605&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

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic acids and derivatives
KlasseHydroxy acids and derivatives
SubclassMedium-chain hydroxy acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentMedium-chain hydroxy acids and derivatives
Alternative Parents Medium-chain fatty acids  Methyl-branched fatty acids  Hydroxy fatty acids  Tertiary alcohols  Monocarboxylic acids and derivatives  Carboxylic acids  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Medium-chain hydroxy acid - Medium-chain fatty acid - Branched fatty acid - Hydroxy fatty acid - Methyl-branched fatty acid - Fatty acyl - Fatty acid - Tertiary alcohol - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxide - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Aliphatic acyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as medium-chain hydroxy acids and derivatives. These are hydroxy acids with a 6 to 12 carbon atoms long side chain.
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

5 results found

Lot NumberCertificate TypeDatumArtikel
E2612214Certificate of AnalysisMay 08, 2026 H194091
E2612215Certificate of AnalysisMay 08, 2026 H194091
E2612216Certificate of AnalysisMay 08, 2026 H194091
E2612217Certificate of AnalysisMay 08, 2026 H194091
E2612218Certificate of AnalysisMay 08, 2026 H194091
Chemische und physikalische Eigenschaften
Molekulargewicht146.180 g/mol
XLogP30.500
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass146.094 Da
Monoisotopic Mass146.094 Da
Topological Polar Surface Area57.500 Ų
Heavy Atom Count10
Formal Charge0
Complexity122.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Lösungsrechner
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