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Molekula

Molekula

Heptyl butyrate

SKU 90037656 CAS 5870-93-9 C11H22O2 MW 186.29 Made to order Bulk quantities on request

Supplying 4,500+ customers in over 80 countries

ISO 9001:2015 & ISO 14001:2015 certified · Supplying laboratories and industry since 2000 · Listed pack sizes are a starting point — we manufacture, source and repack to the quantity you need

Heptyl butyrate is a synthetic ester used primarily in flavors and fragrances for its fruity, pineapple-like aroma, as well as in perfumery and cosmetic applications. It is also employed in food and beverage formulations to replicate natural fruit notes. This clear, colorless liquid has a CAS number of 5870-93-9, a molecular formula of C11H22O2, and a molecular weight of 186.29 g/mol. It is stable at ambient storage conditions and carries no signal word under standard hazard classification. Molekula supplies heptyl butyrate from research to bulk quantities with full documentation and ISO 9001:2015 traceability.

Expect a response within hours Speak to a chemist: +44 (0) 3302 000333

Example image for illustration only. Other packaging and pack sizes are available.

Pricing & pack sizes

Pack sizes & pricing

Pricing on request — packs available from research to bulk quantities.

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Specifications

Property Value
Appearance Colourless to pale-yellow liquid
Melting Point 25°C
Identification (IR) Conforms to reference
Ester Content ≥98.0%
Acid Value (mg KOH/g) ≤2.0%
Relative density (25°C) 0.870 - 0.878

Storage & handling

Property Value
Storage Temperature Ambient
Flash Point 91 °C
Acidity Neutral

Literature values

Published physical properties of the substance, not batch specifications.

Property Value
Melting Point -57.5 °C
Boiling Point 225 to 226 °C at 760 mmHg
Solubility (other solvents) Soluble in alcohol, propylene glycol; insoluble in water

Source: PubChem CID 62592 (Human Metabolome Database (HMDB), Joint FAO/WHO Expert Committee on Food Additives (JECFA))

Identification

Property Value
SKU 90037656
CAS Number 5870-93-9
IUPAC Name heptyl butanoate
EC Number 227-526-5
Molecular Formula C11H22O2
Molecular Weight 186.29
Exact Mass 186.162
SMILES CCCCCCCOC(=O)CCC
InChIKey JPQHLIYIQARLQM-UHFFFAOYSA-N
InChI InChI=1S/C11H22O2/c1-3-5-6-7-8-10-13-11(12)9-4-2/h3-10H2,1-2H3
PubChem CID 62592
REACH Code Y113
TSCA Listed Yes
HTS Code 2915.60.5000
Tariff Code 2915601990

Safety & GHS

Precautionary statements

  • P280 Wear protective gloves/protective clothing/eye protection/face protection

Documents

Certificate of Analysis (CoA) by batch

Enter a lot or batch number to retrieve the CoA for that specific batch. We can generate one from spec data if no PDF is on file.

Synonyms

  • Butanoic acid, heptyl ester
  • Butyric acid, heptyl ester
  • FEMA 2549
  • FEMA No. 2549
  • Heptyl butanoate
  • Heptyl butanoic acid
  • Heptyl butyric acid
  • n-Heptyl butanoate
  • n-Heptyl n-butyrate

Frequently asked questions

What is heptyl butyrate commonly used for?

Heptyl butyrate is primarily used as a flavoring agent in food and beverages, imparting a fruity, pineapple-like aroma and taste, and is also used in perfumery and fragrance formulations.

What is the chemical formula and molecular weight of heptyl butyrate?

The chemical formula is **C11H22O2**, and the molecular weight is **186.29 g/mol**.

How should heptyl butyrate be stored?

Store heptyl butyrate at **ambient temperature** in a tightly sealed container, away from direct sunlight and moisture.

What grades or purity levels of heptyl butyrate does Molekula supply?

Molekula supplies **food-grade and industrial-grade heptyl butyrate**, with purity levels typically ≥98% for food applications.

Can Molekula supply heptyl butyrate in bulk quantities?

Yes, Molekula can supply heptyl butyrate in **bulk quantities**, with flexible packaging options (drums, IBCs, or custom solutions).

What documentation comes with an order of heptyl butyrate?

Each order includes a **Certificate of Analysis (CoA)**, Material Safety Data Sheet (MSDS), and, for food-grade products, a **Food Grade Certificate** and batch-specific documentation.

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