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

CAS: 4536-23-6 Cat. No.: M158388 Fórmula: C7H14O2 Peso molecular: 130.19 Beilstein Registry Number: 1721230 Número CE: 224-883-9
Disponível para encomenda
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
Alemanha (EU)
USA*
Price
Qty
5ml
M158388-5ml
—
Em stock ≥10

22,47€

33,76€
Gravar 11,28 € (33.42%)
25ml
M158388-25ml
—
3 Em stock

78,01€

94,50€
Gravar 16,49 € (17.45%)
100ml
M158388-100ml
—
1 Em stock

248,95€

338,33€
Gravar 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.

Visão geral

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

Specifications

Sinónimos
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
Especificações e pureza
≥98%(GC)
Condições de armazenamento de armazenamento
Room temperature
Enviado em
Normal
Pureza
≥98%(GC)
Nomes e identificadores
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488182634
Sorrisos canónicos
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)
SMILES isoméricas
CCCCC(C)C(=O)O
WGK Alemanha
2
RTECS
MO8400600
Peso molecular
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
ClasseFatty 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
DescriçãoThis 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
Estrutura 3D
Modelo de Estrutura Química Interativa





Certificados(CoA,COO,BSE/TSE e Mapa de Análise)
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 TypeDataItem
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
Propriedades químicas e físicas
SolubilidadeSoluble in water; Soluble in Ether,Alcohol
Índice de refração1.42
Ponto de inflamação (°C)105 °C
Ponto de ebulição (°C)72 °C/5.3 mmHg
Peso molecular130.180 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
Calculadoras de soluções
Revisões

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