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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 1999 · 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.

Quality certificates

Molekula Group is certified to ISO 9001:2015 (quality) and ISO 14001:2015 (environmental management), audited by a UKAS-accredited body. Both certificates are valid to 17 May 2028.

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 heptyl butyrate with an ester content of ≥98.0%.

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 batch-specific documentation.

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