Linallyl benzoate

About Linallyl benzoate

Linallyl benzoate is an aroma chemical (Synthesis grade) carrying the CAS registry number 126-64-7, specified at 95% purity. Its molecular formula is C17H22O2 and its molecular weight is 258.35 g/mol. Its systematic (IUPAC) name is 3,7-dimethylocta-1,6-dien-3-yl benzoate. It is also known as Linalyl benzoate or Linalool, benzoate.

It is supplied as a liquid. Key physical data: a boiling point of 213 °C and a density of 0.98 g/mL at 25 °C. Store in a cool, well-ventilated place, away from sources of ignition, with the container tightly sealed. It carries the GHS signal word “Warning” with 1 hazard statement. Review the Safety Data Sheet before use.

Typical applications include flavour formulation, fragrance compounding, aroma research and food and flavour applications. Our customers for this product work in food and beverage processing and cosmetics and personal care.

Standard pack sizes are 100 g, 500 g and 4 x 25 kg, and every batch ships with a Certificate of Analysis (COA) and we export worldwide.

Typical applications

Flavour formulation
Fragrance compounding
Aroma research
Food & flavour applications

Industries

Specifications & identifiers

Chemical identifiers
Product name	Linallyl benzoate
Catalogue No.	VQ-019254
CAS Number	126-64-7
IUPAC name	3,7-dimethylocta-1,6-dien-3-yl benzoate
Molecular formula	C₁₇H₂₂O₂
Molecular weight	258.35 g/mol
Exact mass	258.162
Grade	Synthesis
Purity / assay	95%
HSN code	29420090
InChIKey	BTJXBZZBBNNTOV-UHFFFAOYSA-N
SMILES	CC(=CCCC(C)(C=C)OC(=O)C1=CC=CC=C1)C
PubChem CID	31353

Physical properties
Physical form	Liquid
Appearance	Liquid
Boiling point	213 °C
Density	0.98 g/mL at 25 °C
LogP (XLogP3)	5
H-bond donors / acceptors	0 / 2
TPSA	26.3 Å²
Synonyms	Linalyl benzoate, Linalool, benzoate, Benzoic acid linalool ester, 1,6-Octadien-3-ol, 3,7-dimethyl-, benzoate, 1,6-Octadien-3-ol, 3,7-dimethyl-, 3-benzoate, 3,7-Dimethyl-1,6-octadien-3-yl benzoate, Linalol benzoate, 1,5-Dimethyl-1-vinyl-4-hexen-1-yl benzoate, 4-Hexen-1-ol, 1,5-dimethyl-1-vinyl-, benzoate, Linalylbenzoate, (RS)-linalyl benzoate, (1,5-dimethyl-1-vinyl-hex-4-enyl) benzoate

Safety & hazard information (GHS)

Harmful / irritant

Signal word: Warning

Hazard statements

H319Causes serious eye irritation

Precautionary statements: P264 + P265, P280, P305 + P351 + P338, P337 + P317

Classification is indicative (aggregated GHS notifications) and may vary by grade and concentration. Always refer to the SDS supplied with your lot.

Documents

Safety Data Sheet (SDS)16-section GHS · on request Certificate of AnalysisTypical / batch COA · on request Specification sheetTDS / MOA · on request

Frequently asked questions

What is the CAS number of Linallyl benzoate?

The CAS Registry Number of Linallyl benzoate is 126-64-7. It is also known as Linalyl benzoate, Linalool, benzoate, Benzoic acid linalool ester.

What is the molecular formula and molecular weight of Linallyl benzoate?

Linallyl benzoate has the molecular formula C17H22O2 and a molecular weight of 258.35 g/mol. Its IUPAC name is 3,7-dimethylocta-1,6-dien-3-yl benzoate.

Which grade and pack sizes of Linallyl benzoate can I order?

We supply Linallyl benzoate in Synthesis (95%) grade, in 100 g, 500 g, 4 x 25 kg packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with Linallyl benzoate?

Yes. Every lot of Linallyl benzoate is shipped with a batch-specific Certificate of Analysis, and a 16-section GHS Safety Data Sheet is provided with the quotation and the shipment.

Can Linallyl benzoate be shipped internationally?

Yes. Linallyl benzoate is classified as hazardous, so it is packed in UN-approved packaging and shipped as dangerous goods under IATA/IMDG rules. We export worldwide on EXW, FOB, CIF and DAP terms.