2-Methylhexanoic Acid - ≥98%(GC) , CAS No.4536-23-6

CAS: 4536-23-6 Cat. No.: M158388 Summenformel: C7H14O2 Molekulargewicht: 130.19 Beilstein Registry Number: 1721230 EG-Nummer: 224-883-9
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GRADE & PURITY ≥98%(GC)
Synonyms
2-Methylhexanoic acid, >=99%, FG | BRN 1721227 | Hexanoic acid, 2-methyl- | alpha-methylhexanoic acid | FEMA No. 3191 | alpha -Methylcaproic acid | DTXCID7024241 | FEMA 3191 | M0947 | FT-0613050 | hexane-2-carboxylic acid | CVKMFSAVYPAZTQ-UHFFFAOYSA- | LU
Storage
Room temperature
Shipped In
Normal
★
Size
Deutschland (EU)
USA*
Price
Qty
5ml
M158388-5ml
—
Auf Lager ≥10

22,47€

33,76€
Speichern 11,28 € (33.42%)
25ml
M158388-25ml
—
3 Auf Lager

78,01€

94,50€
Speichern 16,49 € (17.45%)
100ml
M158388-100ml
—
1 Auf Lager

248,95€

338,33€
Speichern 89,38 € (26.42%)
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥98%(GC) 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 4 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Übersicht

2-methylhexanoic acid has been identified as one of the volatile flavor compounds in the peel and pulp of doum fruit.

Specifications

Synonyme
2-Methylhexanoic acid, >=99%, FG | BRN 1721227 | Hexanoic acid, 2-methyl- | alpha-methylhexanoic acid | FEMA No. 3191 | alpha -Methylcaproic acid | DTXCID7024241 | FEMA 3191 | M0947 | FT-0613050 | hexane-2-carboxylic acid | CVKMFSAVYPAZTQ-UHFFFAOYSA- | LU
Spezifikationen & Reinheit
≥98%(GC)
Storage
Room temperature
Verschickt in
Normal
Reinheit
≥98%(GC)
Namen und Kennungen
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488182634
Kanonisches Lächeln
CCCCC(C)C(=O)O
IUPAC Name
2-methylhexanoic acid
InChIKey
CVKMFSAVYPAZTQ-UHFFFAOYSA-N
INCHI
1S/C7H14O2/c1-3-4-5-6(2)7(8)9/h6H,3-5H2,1-2H3,(H,8,9)
Isomere SMILES
CCCCC(C)C(=O)O
WGK Deutschland
2
RTECS
MO8400600
Molekulargewicht
130.19
Beilstein
1721230
Reaxy-Rn
1721227
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1721227&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
SuperclassLipids and lipid-like molecules
KlasseFatty Acyls
SubclassFatty acids and conjugates
Intermediate Tree Nodes Not available
Direct ParentMedium-chain fatty acids
Alternative Parents Methyl-branched fatty acids  Monocarboxylic acids and derivatives  Carboxylic acids  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Medium-chain fatty acid - Methyl-branched fatty acid - Branched fatty acid - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms.
External Descriptors Branched fatty acids
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.

11 results found

Lot NumberCertificate TypeDatumArtikel
I2608122Certificate of AnalysisSep 11, 2026 M158388
E2113321Certificate of AnalysisFeb 07, 2025 M158388
E2113322Certificate of AnalysisFeb 07, 2025 M158388
C2623158Certificate of AnalysisFeb 21, 2023 M158388
D23031083Certificate of AnalysisFeb 21, 2023 M158388
D23031156Certificate of AnalysisFeb 21, 2023 M158388
D23031157Certificate of AnalysisFeb 21, 2023 M158388
D23031165Certificate of AnalysisFeb 21, 2023 M158388
D23031170Certificate of AnalysisFeb 21, 2023 M158388
D23031179Certificate of AnalysisFeb 21, 2023 M158388
E2410038Certificate of AnalysisApr 21, 2021 M158388
Chemische und physikalische Eigenschaften
LöslichkeitSoluble in water; Soluble in Ether,Alcohol
Brechungsindex1.42
Flammpunkt (°C)105 °C
Siedepunkt (°C)72 °C/5.3 mmHg
Molekulargewicht130.180 g/mol
XLogP32.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass130.099 Da
Monoisotopic Mass130.099 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count9
Formal Charge0
Complexity88.900
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
Citations of This Product
Lösungsrechner
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