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Home › Product Catalog › 3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE

3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE

CAS 141-16-2C14H26O2MW 226.35

3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE (CAS 141-16-2) — formula C14H26O2, molecular weight 226.35; category organic chemicals.

Product Description

3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE (CAS 141-16-2) is a chemical raw material in the organic chemicals category. Its molecular formula C14H26O2 comprises 14 C, 26 H, 2 O atoms. Its molecular weight is about 226.35. Reported physicochemical data: boiling point around 245.00 °C. @ 760.00 mm Hg, LogP about 4.6. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.

Product Overview

CAS Number141-16-2
Molecular FormulaC14H26O2
Molecular Weight226.35
Boiling Point245.00 °C. @ 760.00 mm Hg
LogP4.6
ApplicationsFragrance Ingredients, Flavouring Agent, Flavoring Agents, Butanoic acid, 7-dimethyl-6-octen-1-yl ester: ACTIVE
CategoryOrganic Chemicals

Applications

Documented applications: Fragrance Ingredients, Flavouring Agent, Flavoring Agents, Butanoic acid, 7-dimethyl-6-octen-1-yl ester: ACTIVE.

Technical Profile

What this product is

3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE is a carbon-based organic compound with CAS registry number 141-16-2 and molecular formula C14H26O2 (molecular weight 226.35), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 141-16-2

Its molecular formula C14H26O2 comprises 14 C, 26 H, 2 O atoms.

Also known as: 3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE · citronellyl butyrate

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of 3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE?

The CAS registry number of 3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE is 141-16-2.

What is the molecular formula and molecular weight of 3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE?

Molecular formula C14H26O2, molecular weight 226.35.

What other names is 3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE known by?

It is also registered under: 3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE, citronellyl butyrate.

What are the documented applications of 3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE?

Recorded applications: Fragrance Ingredients, Flavouring Agent, Flavoring Agents, Butanoic acid, 7-dimethyl-6-octen-1-yl ester: ACTIVE.

Which category does 3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE belong to?

Category: Organic Chemicals.

Packaging & documentation

Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.

PubChem Public Data

Independent reference data for 3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE (CAS 141-16-2), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number141-16-2
PubChem CID8835
Molecular formulaC14H26O2
IUPAC name3,7-dimethyloct-6-enyl butanoate
UNII (FDA)IY68QPD54V
FEMA number2312
JECFA number65

Computed descriptors

Molecular Weight226.35
XLogP34.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count9
Exact Mass226.193280068
Monoisotopic Mass226.193280068
Topological Polar Surface Area26.3
Heavy Atom Count16

Physicochemical values on record

Boiling Point245.00 °C. @ 760.00 mm Hg
Boiling Point245 °C
Density0.873-0.883
Refractive Index1.444-1.448

Documented uses on record

    Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional ClassesFlavoring Agents -> JECFA Flavorings Index

    Synonyms and trade names

    Citronellyl butyrate; 141-16-2; 3,7-dimethyloct-6-en-1-yl butanoate; Butanoic acid, 3,7-dimethyl-6-octen-1-yl ester; Butanoic acid, 3,7-dimethyl-6-octenyl ester; FEMA No. 2312; 3,7-Dimethyl-6-octen-1-yl butyrate; Butyric acid, 3,7-dimethyl-6-octenyl ester; (1)-3,7-Dimethyloct-6-enyl butyrate; DTXSID5047405; 6-OCTEN-1-OL, 3,7-DIMETHYL-, BUTYRATE; IY68QPD54V; NSC-46147; DTXCID3027405; RefChem:577481; 205-463-4

    Regulatory listings held on file

    Regulatory & Food ContactEU Flavoring substances
    FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
    Flavoring Agents
    FLAVOURING_AGENT: Flavouring Agent
    Fruit, Rose
    No safety concern at current levels of intake when used as a flavouring agent
    GHS notification summary95.7% (1598 / 1669)

    GHS hazard classification

    GHS notification summary95.7% (1598 / 1669)

    This chemical does not meet GHS hazard criteria for 95.7% (1598 of 1669) of all reports.

    Reported as not meeting GHS hazard criteria by 1598 of 1669 companies (only 4.3% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

    What the public record says

    3,7-DIMETHYL-6-OCTEN-1-YL BUTYRATE · CAS 141-16-2 · C14H26O2. UNII IY68QPD54V. Boiling Point: 245.00 °C. @ 760.00 mm Hg; Boiling Point: 245 °C; Density: 0.873-0.883.

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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