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Flavour & Fragrance Chemicals

β-Ionone, 95%

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Buy β-Ionone, 95% (CAS 79-77-6) from Zemixal. Request a quote with price, lead time and documents. Purity ≥95%. Packs from 100 g.

Pack sizes
β-Ionone, 95% chemical structure
CAS number79-77-6
FormulaC13H20O
Molar mass192.3 g/mol
Physical formLiquid
HS code29142310
UN numberUN 3082
Purity≥95%
InChIKeyPSQYTAPXSHCGMF-BQYQJAHWSA-N
IUPAC name(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one

About β-Ionone, 95%

Researchers and plant chemists source β-Ionone, 95% from Zemixal for routine and specialised work. Key data (≥95%): CAS 79-77-6, formula C13H20O and molar mass 192.3 g/mol. Typical appearance is colourless to yellow liquid.

Where it is used

  • Flavour formulation
  • Fragrance compounding
  • Aroma research
  • Cosmetics & personal care

Storage and safety notes

Physical constants on file: density 0.945 g/mL at 25 °C. Handle with the usual laboratory precautions and consult the SDS supplied with each lot. For transport it ships as UN UN 3082.

Available as 100 g, 500 g, 5 kg and 25 kg. Larger or split packs can be arranged. Every shipment includes a batch certificate of analysis and a 16-section SDS. Send an enquiry through the quote panel and you get a formal offer with Incoterms and delivery time.

Typical uses

  • Flavour formulation
  • Fragrance compounding
  • Aroma research
  • Cosmetics & personal care

Applications

Specifications and identifiers

Specifications of β-Ionone, 95%
Product nameβ-Ionone, 95%
Catalogue numberZX-018431
CAS number79-77-6
IUPAC name(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one
Molecular formulaC13H20O
Molar mass192.3 g/mol
Exact mass192.1514
Purity / assay≥95%
Physical formLiquid
AppearanceColourless to yellow liquid
Density0.945 g/mL at 25 °C
XLogP32.9
H-bond donors / acceptors0 / 1
Topological polar surface area17.1 Ų
HS code29142310
UN numberUN 3082
InChIKeyPSQYTAPXSHCGMF-BQYQJAHWSA-N
SMILESCC1=C(C(CCC1)(C)C)/C=C/C(=O)C
PubChem CID638014
Synonyms4-(2,6,6-Trimethyl-1-cyclohexenyl)-3-buten-2-one, (E)-beta-Ionone, trans-beta-Ionone, (3E)-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-one, (E)-4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-one, 3-Buten-2-one, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (E)-, [E]-4-[2,6,6-trimethyl-1-cyclohexen-1-yl]-3-buten-2-one, I2-Ionone, 4-(2,6,6-Trimethylcyclohex-1-en-1-yl)but-3-en-2-one, b-ionone, (E)-4-(2,6,6-Trimethylcyclohex-1-en-1-yl)but-3-en-2-one, (E)-, A-Ionone

Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.

Safety and GHS hazards

GHS09 Hazardous to the environment
Hazardous to the environment
  • H411Toxic to aquatic life with long lasting effects

Precautionary statements P273, P391, P501

Classification summarised from public GHS notifications. It can vary with grade and concentration, so always follow the SDS supplied with your lot.

Pack sizes

Pack sizes of β-Ionone, 95%
100 gQuoted on request
500 gQuoted on request
5 kgQuoted on request
25 kgQuoted on request

Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.

Questions about β-Ionone, 95%

Which CAS number identifies β-Ionone, 95%?
β-Ionone, 95% is registered under CAS 79-77-6. You may also see it listed as 4-(2,6,6-Trimethyl-1-cyclohexenyl)-3-buten-2-one, (E)-beta-Ionone, trans-beta-Ionone. Our catalogue number for this item is ZX-018431.
What are the formula and molar mass of β-Ionone, 95%?
For β-Ionone, 95%, its formula is C13H20O and its molar mass is 192.3 g/mol. The systematic (IUPAC) name is (E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one. InChIKey PSQYTAPXSHCGMF-BQYQJAHWSA-N lets you match it in any structure database.
What grade and pack sizes are available for β-Ionone, 95%?
This listing is ≥95% purity. Standard packs are 100 g, 500 g, 5 kg, 25 kg. Larger quantities and custom packing can be quoted on request.
Which documents come with β-Ionone, 95%?
Each lot ships with a batch certificate of analysis and a 16-section GHS safety data sheet. A typical COA or specification sheet can be shared with the quotation before you order.
Can Zemixal ship β-Ionone, 95% to my country?
Yes. Because β-Ionone, 95% is classed as hazardous (UN 3082), it travels in UN-approved packaging as dangerous goods under IATA or IMDG rules, with the export paperwork your broker needs.

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