Methyl octanoate

CAS 111-11-5CH3(CH2)6COOCH3Organic Building Blocks

Methyl octanoate (CAS: 111-11-5), with the linear formula CH₃(CH₂)₆COOCH₃ and a molecular weight of 158.24 g/mol, is a fatty ester. This compound presents as a clear liquid and is predominantly used as a building block in chemical synthesis and in cell biology research. Its applications extend to the food and fragrance industries due to its characteristic scent.

IUPAC: Caprylic acid methyl ester,Methyl caprylate
Synonyms: Methyl caprylateCaprylic acid methyl ester

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Methyl octanoate (CH3(CH2)6COOCH3) — chemical structure, CAS 111-11-5; Chemistry, fine chemical supplied by Tech Serve Solutions

Biochemicals and ReagentsBuilding BlocksC8 to C9Carbonyl CompoundsCell BiologyChemical SynthesisEstersFatty AcylsFatty EstersHumulus lupulus (Hops)

01 /Applications

Chemical Synthesis Intermediate

Methyl octanoate serves as a versatile intermediate in organic synthesis. It is employed in the production of various esters, polymers, and other fine chemicals, leveraging its reactive ester group for further functionalization.

Fragrance and Flavour Component

This compound possesses a fruity, apple-like aroma, making it a valuable ingredient in the formulation of fragrances and artificial flavourings. It can contribute specific scent profiles to perfumes, cosmetics, and food products.

Research and Development

In laboratory settings, methyl octanoate is utilised in cell biology studies and as a standard in analytical chemistry. Its well-defined properties make it suitable for investigating biochemical pathways and as a reference compound.

02 /Properties

Molecular weight	158.24
Linear formula	CH3(CH2)6COOCH3
Assay	99%
Grade	puriss.
Boiling point	194-195 °C(lit.)
Density	0.877 g/mL at 25 °C(lit.)
Refractive index	n20/D 1.417(lit.)
Solubility	water: insoluble

03 /Safety & handling

GHS hazard pictogram: Harmful / irritant (GHS07) — Harmful / irritant

Warning

Hazard statements

H315Causes skin irritation

Protective equipment	Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Flash point	69 °C / 156.2 °F
Water hazard class (WGK, DE)	1
Hazard codes (EU)	Xi
Risk statements (R)	38

Hazard information is provided for guidance. Always consult the product Safety Data Sheet (SDS), available on request, before handling.

04 /Identifiers & registry

CAS number

111-11-5

MDL number

MFCD00009551

Beilstein registry

1752270

05 /Quality & supply

Documentation

Every batch ships with a Certificate of Analysis covering assay, identity and purity; the grade is confirmed against your enquiry. Safety Data Sheets and technical data sheets are available on request.

Supply & logistics

Samples for technical evaluation; bulk MOQ by grade and packaging. In-stock material ships in 7–10 working days, worldwide, with full export documentation.

06 /Frequently asked questions

What is Methyl Octanoate used for?

Methyl octanoate is primarily used as an intermediate in chemical synthesis, a component in fragrances and flavours, and in cell biology research.

What is the CAS number and chemical formula for Methyl Octanoate?

The CAS number for Methyl Octanoate is 111-11-5, and its linear formula is CH₃(CH₂)₆COOCH₃.

What grade and purity does Tech Serve Solutions supply for Methyl Octanoate?

Tech Serve Solutions supplies Methyl Octanoate with a purity of 99% and a grade of puriss. We do not represent this product as USP, BP, or EP grade.

How should Methyl Octanoate be handled safely?

Methyl Octanoate is classified as a warning substance (GHS07) and is a skin irritant (H315). Appropriate personal protective equipment, including eyeshields, gloves, and suitable respiratory protection, should be used when handling.