mono-Methyl adipate - ≥98% , CAS No.627-91-8

CAS: 627-91-8 Cat. No.: M102995 Peso molecular: 160.17 Beilstein Registry Number: 1766411 Número EC: 211-019-0
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
MFCD00004418 | DTXCID7024451 | Methyl 5-carboxypentanoate | Monomethyl 1,6-hexanedioate | Adipic acid, monomethyl ester (8CI) | Adipic acid monomethyl ester | 1-methyl ester Hexanedioic acid | AM20100535 | Hexanedioic acid, monomethyl ester | NCGC00255865
Storage
Store at 2-8°C
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5g
M102995-5g
3
9,90US$
10g
M102995-10g
3
10,90US$
25g
M102995-25g
1
11,90US$
100g
M102995-100g
2

26,90US$

40,90US$
Guardar 14,00 US$ (34.23%)
250g
M102995-250g
1

58,90US$

88,90US$
Guardar 30,00 US$ (33.75%)
500g
M102995-500g
1

114,90US$

172,90US$
Guardar 58,00 US$ (33.55%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice 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 3 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
MFCD00004418 | DTXCID7024451 | Methyl 5-carboxypentanoate | Monomethyl 1, 6-hexanedioate | Adipic acid, monomethyl ester (8CI) | Adipic acid monomethyl ester | 1-methyl ester Hexanedioic acid | AM20100535 | Hexanedioic acid, monomethyl ester | NCGC00255865
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C
Enviado en
Wet ice
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Pureza
≥98%
Nombres e identificadores
Pubchem Sid504752306
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504752306
Sonrisas canónicasCOC(=O)CCCCC(=O)O
IUPAC Name6-methoxy-6-oxohexanoic acid
InChIKeyUOBSVARXACCLLH-UHFFFAOYSA-N
INCHI1S/C7H12O4/c1-11-7(10)5-3-2-4-6(8)9/h2-5H2,1H3,(H,8,9)
Isómeros SMILES COC(=O)CCCCC(=O)O
WGK Alemania 3
Peso molecular 160.17
Beilstein 1766411
Reaxy-Rn 1766411
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1766411&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
ClaseFatty Acyls
SubclassFatty acids and conjugates
Intermediate Tree Nodes Not available
Direct ParentMedium-chain fatty acids
Alternative Parents Fatty acid methyl esters  Dicarboxylic acids and derivatives  Methyl esters  Carboxylic acids  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Medium-chain fatty acid - Fatty acid methyl ester - Fatty acid ester - Dicarboxylic acid or derivatives - Methyl ester - Carboxylic acid ester - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
DescripciónThis 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 dicarboxylic acid monoester
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
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.

22 results found

Lot NumberCertificate TypeFechaArticulo
H2302685Certificate of AnalysisMay 15, 2025 M102995
H2302686Certificate of AnalysisMay 15, 2025 M102995
H2302694Certificate of AnalysisMay 15, 2025 M102995
H2302689Certificate of AnalysisMay 15, 2025 M102995
H2302690Certificate of AnalysisMay 15, 2025 M102995
H2302691Certificate of AnalysisMay 15, 2025 M102995
H2302693Certificate of AnalysisMay 15, 2025 M102995
G2522248Certificate of AnalysisApr 03, 2025 M102995
G2522249Certificate of AnalysisApr 03, 2025 M102995
G2522355Certificate of AnalysisApr 03, 2025 M102995
G2522364Certificate of AnalysisApr 03, 2025 M102995
I2111160Certificate of AnalysisMar 04, 2025 M102995
I2111159Certificate of AnalysisMar 04, 2025 M102995
I2111158Certificate of AnalysisMar 04, 2025 M102995
K2429082Certificate of AnalysisJul 13, 2023 M102995
H2302692Certificate of AnalysisJul 13, 2023 M102995
H2302687Certificate of AnalysisJul 13, 2023 M102995
H2302684Certificate of AnalysisJul 13, 2023 M102995
I2113135Certificate of AnalysisJun 13, 2023 M102995
A1921090Certificate of AnalysisSep 21, 2022 M102995
B2021023Certificate of AnalysisJun 23, 2022 M102995
B2223044Certificate of AnalysisDec 22, 2021 M102995

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Propiedades químicas y físicas
SolubilidadNot miscible or difficult to mix with water.
Índice de refracción1.441
Punto de inflamación (°F)235.4 °F
Punto de inflamación (°C)113 °C
Punto de ebullición (°C)162°C/10mmHg
Punto de fusión (°C)7-9°C
Peso molecular160.170 g/mol
XLogP30.700
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass160.074 Da
Monoisotopic Mass160.074 Da
Topological Polar Surface Area63.600 Ų
Heavy Atom Count11
Formal Charge0
Complexity141.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
Referencias
1. Linchuan Cong, Yupeng Wu, Nan Lin, Xinxin Li, Fangbing Liu, Fuyu Han, Jin Yang, Ciduo Wang, Haibo Lin.  (2023)  Boosting decarboxylation of monomethyl adipate coupling to dimethyl sebacate through Pt electrode at high current density.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2023.148331]
2. Yun Liu, Shuai Zhu, Xiazhong Liu.  (2023)  Effect of Four Extraction Processes with Acetone-Ethanol Protocols on the Properties of Egg Yolk Phosphatidylcholine and the Structure of Residual Protein.  Journal of Oleo Science,      [PMID:36504189] [10.5650/jos.ess22219]
3. Linchuan Cong, Xinxin Li, Fuyu Han, Yupeng Wu, Kewen Ma, Ciduo Wang, Nan Lin, Haibo Lin.  (2025)  Electrode interfacial wettability engineering for high-efficiency synthesis of dimethyl sebacate via Kolbe electrolysis.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.171314]
Calculadoras de soluciones
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