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Phenethyl senecioate

CAS 42078-65-9C13H16O2MW 204.26

Phenethyl senecioate (CAS 42078-65-9) — formula C13H16O2, molecular weight 204.26; category organic chemicals.

Product Description

Phenethyl senecioate (CAS 42078-65-9) is a chemical raw material in the organic chemicals category. Its molecular formula C13H16O2 comprises 13 C, 16 H, 2 O atoms. Its molecular weight is about 204.26. Reported physicochemical data: boiling point around 285.00 to 287.00 °C. @ 760.00 mm Hg, LogP about 3.7. 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 Number42078-65-9
Molecular FormulaC13H16O2
Molecular Weight204.26
Boiling Point285.00 to 287.00 °C. @ 760.00 mm Hg
LogP3.7
ApplicationsFlavouring Agent, Flavoring Agents, 2-Butenoic acid, 3-methyl, 2-phenylethyl ester: ACTIVE
CategoryOrganic Chemicals

Applications

Documented applications: Flavouring Agent, Flavoring Agents, 2-Butenoic acid, 3-methyl, 2-phenylethyl ester: ACTIVE.

Technical Profile

What this product is

Phenethyl senecioate is a carbon-based organic compound with CAS registry number 42078-65-9 and molecular formula C13H16O2 (molecular weight 204.26), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 42078-65-9

Its molecular formula C13H16O2 comprises 13 C, 16 H, 2 O atoms.

Also known as: Phenethyl senecioate · 千里光苯乙酯 · phenethyl 3-methylbut-2-enoate

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of Phenethyl senecioate?

The CAS registry number of Phenethyl senecioate is 42078-65-9.

What is the molecular formula and molecular weight of Phenethyl senecioate?

Molecular formula C13H16O2, molecular weight 204.26.

What other names is Phenethyl senecioate known by?

It is also registered under: Phenethyl senecioate, 千里光苯乙酯, phenethyl 3-methylbut-2-enoate.

What are the documented applications of Phenethyl senecioate?

Recorded applications: Flavouring Agent, Flavoring Agents, 2-Butenoic acid, 3-methyl, 2-phenylethyl ester: ACTIVE.

Which category does Phenethyl senecioate 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 Phenethyl senecioate (CAS 42078-65-9), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number42078-65-9
PubChem CID61997
Molecular formulaC13H16O2
IUPAC name2-phenylethyl 3-methylbut-2-enoate
UNII (FDA)RB4P98KP6R
FEMA number2869
JECFA number998

Computed descriptors

Molecular Weight204.26
XLogP33.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass204.115029749
Monoisotopic Mass204.115029749
Topological Polar Surface Area26.3
Heavy Atom Count15

Physicochemical values on record

Boiling Point285.00 to 287.00 °C. @ 760.00 mm Hg
Boiling Point285 °C
Density1.011-1.019
Refractive Index1.514-1.520

Documented uses on record

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

    Synonyms and trade names

    Phenethyl senecioate; 2-phenylethyl 3-methylbut-2-enoate; 2-Butenoic acid, 3-methyl-, 2-phenylethyl ester; 42078-65-9; 2-Phenylethyl 3-methyl-2-butenoate; Phenethyl 3-methylbut-2-enoate; Phenethyl 3-methylcrotonate; 2-Phenylethyl senecioate; Phenethyl 3,3-dimethylacrylate; FEMA No. 2869; Phenylethyl beta,beta-dimethylacrylate; EINECS 255-649-4; RB4P98KP6R; 2-Butenoic acid, 3-methyl-, 2-phenethyl ester; DTXSID5068366; PHENETHYL SENECIOATE [FHFI]

    Regulatory listings held on file

    Regulatory & Food ContactEU Flavoring substances
    FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT
    Flavoring Agents
    FLAVOURING_AGENT: Flavouring Agent
    Floral
    No safety concern at current levels of intake when used as a flavouring agent

    What the public record says

    phenethyl 3-methylbut-2-enoate · CAS 42078-65-9 · C13H16O2. UNII RB4P98KP6R. Boiling Point: 285.00 to 287.00 °C. @ 760.00 mm Hg; Boiling Point: 285 °C; Density: 1.011-1.019.

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

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