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1-phenylethyl isobutyrate

CAS 7775-39-5C12H16O2MW 192.25

1-phenylethyl isobutyrate (CAS No. 7775-39-5) 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 Organic Chemicals. Bulk quantities are available with COA; purity and packaging are subject to batch COA and order confirmation.

Product Overview

CAS Number7775-39-5
Molecular FormulaC12H16O2
Molecular Weight192.25
Boiling Point219 °C; 80 °C (3 mm Hg)
LogP3.1
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)
ApplicationsOrganic Chemicals
CategoryOrganic Chemicals

Applications

Organic Chemicals

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 1-phenylethyl isobutyrate?

The CAS number of 1-phenylethyl isobutyrate is 7775-39-5.

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 1-phenylethyl isobutyrate?

Main applications include Organic Chemicals.

How do I buy 1-phenylethyl isobutyrate 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

1-phenylethyl isobutyrate · CAS 7775-39-5 · C12H16O2. UNII K9REG8PIWP. Boiling Point: 219 °C; 80 °C (3 mm Hg); Density: 0.977-0.983; Refractive Index: 1.480-1.486.

Identification

CAS Registry Number7775-39-5
PubChem CID569214
Molecular formulaC12H16O2
IUPAC name1-phenylethyl 2-methylpropanoate
UNII (FDA)K9REG8PIWP
FEMA number2687
JECFA number804

Computed Descriptors

Molecular Weight192.25
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass192.115029749
Monoisotopic Mass192.115029749
Topological Polar Surface Area26.3
Heavy Atom Count14
Formal Charge0

Physical & Chemical Properties

Boiling Point219 °C; 80 °C (3 mm Hg)
Density0.977-0.983
Refractive Index1.480-1.486

Physical description & handling notes

  • colourless oily liquid with a sweet, floral-green odour
  • insoluble in water; soluble in organic solvents, oils
  • miscible at room temperature (in ethanol)

Regulatory Status

Regulatory & Food ContactEU Flavoring substances
FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
Flavoring Agents
FLAVOURING_AGENT: Flavouring Agent
Fruit
No safety concern at current levels of intake when used as a flavouring agent
GHS notification summary100% (91 / 91)

GHS Hazard Classification

GHS notification summary100% (91 / 91)

This chemical does not meet GHS hazard criteria for 100% (91 of 91) of all reports.

Reported as not meeting GHS hazard criteria by 91 of 91 companies. For more detailed information, please visit ECHA C&L website.

Documented Uses

  • Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
  • Flavoring Agents -> JECFA Flavorings Index
  • Propanoic acid, 2-methyl-, 1-phenylethyl ester: ACTIVE

Synonyms

7775-39-5; 1-phenylethyl 2-methylpropanoate; alpha-Methylbenzyl isobutyrate; Propanoic acid, 2-methyl-, 1-phenylethyl ester; K9REG8PIWP; FEMA No. 2687; Methylphenylcarbinyl isobutyrate; alpha-Methylbenzyl 2-methylpropanoate; Isobutyric acid, alpha-methylbenzyl ester; DTXSID50864119; RefChem:555863; DTXCID80812668; 1-Phenylethyl isobutyrate; Styralyl isobutyrate; UNII-K9REG8PIWP; 1-Phenyl-1-ethyl isobutyrate

Frequently Asked Questions

What are the CAS number and molecular formula of 1-phenylethyl isobutyrate?

CAS 7775-39-5; molecular formula C12H16O2; molecular weight — g/mol.

What other names is 1-phenylethyl isobutyrate known by?

7775-39-5, 1-phenylethyl 2-methylpropanoate, alpha-Methylbenzyl isobutyrate, Propanoic acid, 2-methyl-, 1-phenylethyl ester, K9REG8PIWP, FEMA No. 2687.

What is the regulatory status of 1-phenylethyl isobutyrate?

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

Is 1-phenylethyl isobutyrate classified as hazardous?

100% of GHS notifications report no hazard classification (91 of 91).

What are the key physical properties of 1-phenylethyl isobutyrate?

Boiling Point: 219 °C; 80 °C (3 mm Hg); Density: 0.977-0.983; Refractive Index: 1.480-1.486.

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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