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Phenethyl 2-methylbutyrate

CAS 24817-51-4C13H18O2MW 206.13 g/mol

Phenethyl 2-methylbutyrate (CAS 24817-51-4) — formula C13H18O2, molecular weight 206.13 g/mol; category food flavors.

Product Description

Phenethyl 2-methylbutyrate (CAS 24817-51-4) is a chemical raw material in the food flavors category. Its molecular formula C13H18O2 comprises 13 C, 18 H, 2 O atoms. Its molecular weight is about 206.13 g/mol. Reported physicochemical data: boiling point around 136.00 °C. @ 30.00 mm Hg, LogP about 3.5. 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 Number24817-51-4
Molecular FormulaC13H18O2
Molecular Weight206.13 g/mol
Boiling Point136.00 °C. @ 30.00 mm Hg
LogP3.5
ApplicationsFragrance Ingredients, Flavouring Agent, Flavoring Agents, Butanoic acid, 2-methyl, 2-phenylethyl ester: ACTIVE
CategoryFlavors

Applications

Documented applications: Fragrance Ingredients, Flavouring Agent, Flavoring Agents, Butanoic acid, 2-methyl, 2-phenylethyl ester: ACTIVE.

Technical Profile

What this product is

Phenethyl 2-methylbutyrate is a flavoring compound with CAS registry number 24817-51-4 and molecular formula C13H18O2 (molecular weight 206.13 g/mol), belonging to the food flavors segment of chemical raw materials.

Identification

CAS number: 24817-51-4

Its molecular formula C13H18O2 comprises 13 C, 18 H, 2 O atoms.

Also known as: Phenethyl 2-methylbutyrate · 2-phenylethyl 2-methylbutyrate

Category: food flavors

Frequently Asked Questions

What is the CAS number of Phenethyl 2-methylbutyrate?

The CAS registry number of Phenethyl 2-methylbutyrate is 24817-51-4.

What is the molecular formula and molecular weight of Phenethyl 2-methylbutyrate?

Molecular formula C13H18O2, molecular weight 206.13 g/mol.

What other names is Phenethyl 2-methylbutyrate known by?

It is also registered under: Phenethyl 2-methylbutyrate, 2-phenylethyl 2-methylbutyrate.

What are the documented applications of Phenethyl 2-methylbutyrate?

Recorded applications: Fragrance Ingredients, Flavouring Agent, Flavoring Agents, Butanoic acid, 2-methyl, 2-phenylethyl ester: ACTIVE.

Which category does Phenethyl 2-methylbutyrate belong to?

Category: Flavors.

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 2-methylbutyrate (CAS 24817-51-4), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number24817-51-4
PubChem CID520148
Molecular formulaC13H18O2
Molecular weight206.13 g/mol
IUPAC name2-phenylethyl 2-methylbutanoate
InChIKeyKVKKTLBBYFABAZ-UHFFFAOYSA-N
UNII (FDA)4D2I5SJ45Q
FEMA number3632
JECFA number993

Computed descriptors

Molecular Weight206.28
XLogP33.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass206.130679813
Monoisotopic Mass206.130679813
Topological Polar Surface Area26.3
Heavy Atom Count15

Physicochemical values on record

Boiling Point136.00 °C. @ 30.00 mm Hg
Boiling Point230 °C
Density0.974-0.980
Refractive Index1.481-1.489

Documented uses on record

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

    Synonyms and trade names

    24817-51-4; Phenethyl 2-methylbutyrate; 2-Phenylethyl 2-methylbutanoate; Butanoic acid, 2-methyl-, 2-phenylethyl ester; Phenylethyl 2-methylbutyrate; Butyric acid, 2-methyl-, phenethyl ester; FEMA No. 3632; DTXSID2047567; 4D2I5SJ45Q; DTXCID0027567; RefChem:860578; 246-476-5; phenethyl 2-methylbutanoate; 2-Phenylethyl 2-methylbutyrate; Phenylethyl 2-methylbutanoate; Benzylcarbinyl 2-methylbutyrate

    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
    Floral
    No safety concern at current levels of intake when used as a flavouring agent
    GHS notification summary100% (262 / 262)

    GHS hazard classification

    GHS notification summary100% (262 / 262)

    This chemical does not meet GHS hazard criteria for 100% (262 of 262) of all reports.

    Reported as not meeting GHS hazard criteria by 262 of 262 companies. For more detailed information, please visit ECHA C&L website.

    What the public record says

    Phenethyl 2-methylbutyrate is identified by CAS 24817-51-4, molecular formula C13H18O2 and molecular weight 206.13 g/mol. UNII 4D2I5SJ45Q; InChIKey KVKKTLBBYFABAZ-UHFFFAOYSA-N. Boiling Point: 136.00 °C. @ 30.00 mm Hg; Boiling Point: 230 °C; Density: 0.974-0.980.

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

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