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Isoamyl phenylacetate

CAS 102-19-2C13H18O2MW 206.13 g/mol

Isoamyl phenylacetate (CAS No. 102-19-2) is supplied by Jinan Shenghe Chemical Co., Ltd. with a typical purity of 按批次COA提供(不公开发布). Main applications include Flavors. Bulk quantities are available with COA; purity and packaging are subject to batch COA and order confirmation.

Product Overview

CAS Number102-19-2
Molecular FormulaC13H18O2
Molecular Weight206.13 g/mol
Boiling Point268.00 °C. @ 760.00 mm Hg
LogP3.870
Purity按批次COA提供(不公开发布)
Packaging按订单/批次确认(不公开发布)
ApplicationsFlavors
CategoryFlavors

Applications

Flavors

Packaging & Storage

Packaging按订单/批次确认(不公开发布)
Purity按批次COA提供(不公开发布)
StorageSealed, cool and dry place
ShippingStandard chemical transport
SampleAvailable on request
Lead TimeIn stock / per order

Quality & Documentation

COA (Certificate of Analysis) is provided with every batch. MSDS/technical data sheets and third-party test reports are available on request. Purity and packaging are subject to batch COA and order confirmation.

Frequently Asked Questions

What is the CAS number of Isoamyl phenylacetate?

The CAS number of Isoamyl phenylacetate is 102-19-2.

What purity and packaging are available?

Typical purity is 按批次COA提供(不公开发布), supplied in 按订单/批次确认(不公开发布), with COA provided.

What are the applications of Isoamyl phenylacetate?

Main applications include Flavors.

How do I buy Isoamyl phenylacetate or get a quote?

Email info@591daili.com or reach us on WhatsApp with the product name, CAS number and required quantity; quotes within one business day. Supplier: Jinan Shenghe Chemical Co., Ltd..

PubChem Public Data

Description

Isoamyl phenylacetate is identified by CAS 102-19-2, molecular formula C13H18O2 and molecular weight 206.13 g/mol. UNII E5RHQ50DDC; ChEBI 191542; InChIKey QWBQBUWZZBUFHN-UHFFFAOYSA-N. Boiling Point: 268.00 °C. @ 760.00 mm Hg; Boiling Point: 268 °C; Density: 0.975-0.981.

Identification

CAS Registry Number102-19-2
PubChem CID7600
Molecular formulaC13H18O2
Molecular weight206.13 g/mol
IUPAC name3-methylbutyl 2-phenylacetate
InChIKeyQWBQBUWZZBUFHN-UHFFFAOYSA-N
UNII (FDA)E5RHQ50DDC
ChEBI IDCHEBI:191542
FEMA number2081
JECFA number1014

Computed Descriptors

Molecular Weight206.28
XLogP33.6
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
Formal Charge0

Physical & Chemical Properties

Boiling Point268.00 °C. @ 760.00 mm Hg
Boiling Point268 °C
Density0.975-0.981
LogP3.870
Refractive Index1.483-1.490

Physical description & handling notes

  • Liquid
  • Colourless liquid; sweet musky animal odour with fruity balsamic undertone reminiscent of fresh cocoa beans
  • Insoluble in water; soluble in oils
  • 1 mL in 1 mL 95% ethanol (in ethanol)

Regulatory Status

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 summary97.1% (1598 / 1646)

GHS Hazard Classification

GHS notification summary97.1% (1598 / 1646)

This chemical does not meet GHS hazard criteria for 97.1% (1598 of 1646) of all reports.

Reported as not meeting GHS hazard criteria by 1598 of 1646 companies (only 2.9% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

Documented Uses

  • Flavoring Agents -> JECFA Flavorings Index
  • Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
  • Information on 4 consumer products that contain Isopentyl phenylacetate
 in the following categories is provided:
  • Benzeneacetic acid, 3-methylbutyl ester: ACTIVE

Synonyms

Isoamyl phenylacetate; 102-19-2; Isopentyl phenylacetate; Benzeneacetic acid, 3-methylbutyl ester; 3-Methylbutyl phenylacetate; 3-methylbutyl 2-phenylacetate; Isoamyl alpha-toluate; FEMA No. 2081; isoamyl phenyl acetate; NSC 60582; UNII-E5RHQ50DDC; E5RHQ50DDC; EINECS 203-012-6; BRN 1951778; iso-Amyl phenylacetate; AI3-36555

Frequently Asked Questions

What are the CAS number and molecular formula of Isoamyl phenylacetate?

CAS 102-19-2; molecular formula C13H18O2; molecular weight 206.13 g/mol.

What other names is Isoamyl phenylacetate known by?

Isoamyl phenylacetate, 102-19-2, Isopentyl phenylacetate, Benzeneacetic acid, 3-methylbutyl ester, 3-Methylbutyl phenylacetate, 3-methylbutyl 2-phenylacetate.

What is the regulatory status of Isoamyl phenylacetate?

Documented regulatory listings: EU Flavoring substances; FDA Substance added to food: FLAVORING AGENT OR ADJUVANT; Flavoring Agents.

Is Isoamyl phenylacetate classified as hazardous?

97.1% of GHS notifications report no hazard classification (1598 of 1646).

What are the key physical properties of Isoamyl phenylacetate?

Boiling Point: 268.00 °C. @ 760.00 mm Hg; Boiling Point: 268 °C; Density: 0.975-0.981; LogP: 3.870.

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.

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Supplier: Jinan Shenghe Chemical Co., Ltd.

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