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Aliphatic and alicyclic building blocks

Prenyl caproate

Also known as Prenyl hexanoate, 3-Methylbut-2-enyl hexanoate, Hexanoic acid, 3-methyl-2-butenyl ester

CAS 76649-22-4Formula C11H20O2Molar mass 184.28 g/molEC 278-515-7
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Prenyl caproate chemical structure, C11H20O2, CAS 76649-22-4
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
76649-22-4
Formula
C11H20O2
Molar mass
184.28 g/mol
EC number
278-515-7
HS code
291590
Category
Aliphatic and alicyclic building blocks

What is Prenyl caproate?

Plain description, key identifiers and synonyms

Prenyl caproate is a fatty acid ester.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-methylbut-2-enyl hexanoate
CAS number
76649-22-4 CAS number cross-checked
EC number
278-515-7
Molecular formula
C11H20O2
UNII
44Y3T9J41Z
InChIKey
MUVXQQVJNUBWPF-UHFFFAOYSA-N
InChI
InChI=1S/C11H20O2/c1-4-5-6-7-11(12)13-9-8-10(2)3/h8H,4-7,9H2,1-3H3
SMILES (canonical and isomeric)
CCCCCC(=O)OCC=C(C)C

Synonyms

  • Prenyl hexanoate
  • 3-Methylbut-2-enyl hexanoate
  • Hexanoic acid, 3-methyl-2-butenyl ester
  • 3-methylbut-2-en-1-yl hexanoate
  • Hexanoic acid, 3-methyl-2-buten-1-yl ester
  • Hexanoic acid,3-methyl-2-buten-1-yl ester
  • 3-Methyl-2-butenyl hexanoate
  • Hexanoic acid, 3-methylbut-2-enyl ester
  • 3-Methyl-2-butenyl hexanoate #

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
184.28 g/molcalc.
Exact mass
184.1463 Dacalc.
LogP (octanol/water)
3.08calc.
Topological polar surface area
26.3 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
6calc.
Heavy atoms
13calc.
Rings
0calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.73calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Prenyl caproate suppliers

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Prenyl caproate price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

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Uses and applications

What the substance is used for, by industry and function

Functional uses

  • Flavouring and nutrient

Regulatory status

Inventories, regulations and trade controls that list this substance

United States

  • TSCA inventory (USA)
    Status: Active in US commerce

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Prenyl caproate is traded under.

HS 2915.90Indicative HS code

Saturated acyclic monocarboxylic acids, anhydrides, halides, peroxides, peroxyacids and halogenated…

World exports in 2024
$3.42B
+5.6% vs 2023, imports $3.55B
2019 to 2024
Top exporters
  1. Indonesia15.9%
  2. Germany13.0%
  3. Malaysia12.4%
Top importers
  1. China14.4%
  2. Netherlands11.7%
  3. United States11.5%
Reported customs values in USD, not prices.Full trade data

The HS code shown for Prenyl caproate is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Prenyl caproate, based on the data on this page

What is Prenyl caproate?

Prenyl caproate is a fatty acid ester.

What is the CAS number of Prenyl caproate?

The CAS registry number of Prenyl caproate is 76649-22-4.

What is the molecular formula and weight of Prenyl caproate?

The molecular formula of Prenyl caproate is C11H20O2 and its molar mass is 184.28 g/mol.

What is Prenyl caproate used for?

Known uses and roles of Prenyl caproate include building blocks in research and laboratory and flavouring and nutrient.

Is Prenyl caproate hazardous?

No GHS hazard classification for Prenyl caproate is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Prenyl caproate?

Prenyl caproate is usually classified under HS code 291590 (Saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Prenyl caproate?

Post a free request on CompoundList and suppliers of Prenyl caproate will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Prenyl caproate?

Suppliers quote Prenyl caproate on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Prenyl caproate

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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