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Isobornyl isobutyrate

CAS 85586-67-0C14H24O2MW 224.18 g/mol

Isobornyl isobutyrate (CAS No. 85586-67-0) 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;Flavors. Bulk quantities are available with COA; purity and packaging are subject to batch COA and order confirmation.

Specifications

CAS Number85586-67-0
Molecular FormulaC14H24O2
Molecular Weight224.18 g/mol
Boiling Point131-133 °C (19 mm Hg)
LogP4.3
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;Flavors
CategoryOrganic Chemicals|Flavors

Where it is used

Organic Chemicals;Flavors

Packaging & Supply

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
Lead TimeIn stock / per order

Documents & Support

COA provided with every batch; MSDS and technical documents available on request. Email us with product name and CAS number for a quote within one business day.

Frequently Asked Questions

What is the CAS number of Isobornyl isobutyrate?

The CAS number of Isobornyl isobutyrate is 85586-67-0.

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 Isobornyl isobutyrate?

Main applications include Organic Chemicals;Flavors.

How do I buy Isobornyl 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

Isobornyl isobutyrate is identified by CAS 85586-67-0, molecular formula C14H24O2 and molecular weight 224.18 g/mol. UNII 0HWY1Q2V54; ChEBI 171770; InChIKey KRKIAJBQOUBNSE-GYSYKLTISA-N. Boiling Point: 131-133 °C (19 mm Hg); Density: 0.958-0.964; Refractive Index: 1.460-1.466.

Identification

CAS Registry Number85586-67-0
PubChem CID174490
Molecular formulaC14H24O2
Molecular weight224.18 g/mol
IUPAC name[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] 2-methylpropanoate
InChIKeyKRKIAJBQOUBNSE-GYSYKLTISA-N
UNII (FDA)0HWY1Q2V54
ChEBI IDCHEBI:171770
FEMA number4146
JECFA number1863

Computed Descriptors

Molecular Weight224.34
XLogP34.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass224.177630004
Monoisotopic Mass224.177630004
Topological Polar Surface Area26.3
Heavy Atom Count16
Formal Charge0

Physical & Chemical Properties

Boiling Point131-133 °C (19 mm Hg)
Density0.958-0.964
Refractive Index1.460-1.466

Physical description & handling notes

  • Colourless liquid; Earthy camphorous aroma
  • Practically insoluble to insoluble in water
  • Soluble (in ethanol)

Regulatory Status

Regulatory & Food ContactEU Flavoring substances
FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
Flavoring Agents
FLAVOURING_AGENT: Flavouring Agent
Spice
No safety concern at current levels of intake when used as a flavouring agent
GHS notification summary100% (1410 / 1410)

GHS Hazard Classification

GHS notification summary100% (1410 / 1410)

This chemical does not meet GHS hazard criteria for 100% (1410 of 1410) of all reports.

Reported as not meeting GHS hazard criteria by 1410 of 1410 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-, (1R,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, rel-: ACTIVE

Synonyms

Isobornyl isobutyrate; 85586-67-0; EINECS 287-872-8; 0HWY1Q2V54; Propanoic acid, 2-methyl-, (1R,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, rel-; exo-1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl isobutyrate; FEMA NO. 4146; DTXSID40888667; Propanoic acid, 2-methyl-, (1R,2R,4R)-1,7,7-trimethylbicyclo(2.2.1)hept-2-yl ester, rel-; Exo-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl isobutyrate; PROPANOIC ACID, 2-METHYL-, 1,7,7-TRIMETHYLBICYCLO(2.2.1)HEPT-2-YL ESTER, EXO-; Propanoic acid, 2-methyl-, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, exo-; RefChem:791574; DTXCID501027943; (+-)-ISOBORNYL ISOBUTYRATE; ISOBORNYL ISOBUTYRATE, (+-)-

Frequently Asked Questions

What are the CAS number and molecular formula of Isobornyl isobutyrate?

CAS 85586-67-0; molecular formula C14H24O2; molecular weight 224.18 g/mol.

What other names is Isobornyl isobutyrate known by?

Isobornyl isobutyrate, 85586-67-0, EINECS 287-872-8, 0HWY1Q2V54, Propanoic acid, 2-methyl-, (1R,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester, rel-, exo-1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl isobutyrate.

What is the regulatory status of Isobornyl isobutyrate?

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

Is Isobornyl isobutyrate classified as hazardous?

100% of GHS notifications report no hazard classification (1410 of 1410).

What are the key physical properties of Isobornyl isobutyrate?

Boiling Point: 131-133 °C (19 mm Hg); Density: 0.958-0.964; Refractive Index: 1.460-1.466.

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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