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heptyl isobutyrate

CAS 2349-13-5C11H22O2MW 186.16 g/mol

heptyl isobutyrate (CAS No. 2349-13-5) is supplied by Jinan Shenghe Chemical Co., Ltd. with a typical purity of per batch COA (not published). Main applications include Organic Chemicals;Flavors. Bulk quantities are available with COA; purity and packaging are subject to batch COA and order confirmation.

Product Overview

CAS Number2349-13-5
Molecular FormulaC11H22O2
Molecular Weight186.16 g/mol
Boiling Point212.00 °C. @ 760.00 mm Hg
LogP4
Purityper batch COA (not published)
Packagingper order / batch confirmation (not published)
ApplicationsOrganic Chemicals;Flavors
CategoryOrganic Chemicals|Flavors

Applications

Organic Chemicals;Flavors

Packaging & Storage

Packagingper order / batch confirmation (not published)
Purityper batch COA (not published)
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.

Product Profile

Product Overview

heptyl isobutyrate is a carbon-based organic compound with CAS registry number 2349-13-5 and molecular formula C11H22O2 (molecular weight 186.16 g/mol), belonging to the organic chemicals segment of chemical raw materials.

Organic chemicals are the largest family of carbon-based compounds, widely used across pharmaceuticals, agrochemicals, materials, cosmetics and food industries.

Jinan Shenghe Chemical Co., Ltd. supplies heptyl isobutyrate with stable inventory and provides a Certificate of Analysis (COA) with each batch; custom repacking is available per process requirement.

Chemical Identity & Nomenclature

CAS number: 2349-13-5 — searchable in PubChem for physicochemical, safety and regulatory data.

Its molecular formula C11H22O2 comprises 11 C, 22 H, 2 O atoms.

Also known as: heptyl isobutyrate

Category: organic chemicals / food flavors

Applications & Use Cases

Downstream uses span pharmaceutical ingredients, agrochemicals, dyes, solvents, surfactants, food additives and polymer materials.

Specifications & Quality

Typical purity is per batch COA (not published). Packaging is per order / batch confirmation (not published). Storage: sealed, in a cool and dry place. Each batch ships with a COA; MSDS and other technical documents are available on request.

Sourcing & Support

Supplier: Jinan Shenghe Chemical Co., Ltd.. Samples can be arranged on request; lead time depends on stock and order size. Quotes are returned within one business day by email or WhatsApp.

Email: info@591daili.com · Tel/WhatsApp: +86-18553102138

Frequently Asked Questions

What is the CAS number of heptyl isobutyrate?

The CAS number of heptyl isobutyrate is 2349-13-5.

What purity and packaging are available?

Typical purity is per batch COA (not published), supplied in per order / batch confirmation (not published), with COA provided.

What are the applications of heptyl isobutyrate?

Main applications include Organic Chemicals;Flavors.

What quality documents are provided?

Each batch ships with a Certificate of Analysis (COA). MSDS and other technical documents are available on request.

How should heptyl isobutyrate be stored and handled?

Store sealed in a cool, dry place. Handling and PPE follow the MSDS supplied with the batch; general chemical-handling precautions are recommended.

Can I request a sample?

Samples are available on request. Please contact us at info@591daili.com or via WhatsApp for details.

How do I buy heptyl 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

heptyl isobutyrate is identified by CAS 2349-13-5, molecular formula C11H22O2 and molecular weight 186.16 g/mol. UNII FE997Z53QF; ChEBI 179379; InChIKey RFDUMBPGZUIKOG-UHFFFAOYSA-N. Boiling Point: 212.00 °C. @ 760.00 mm Hg; Boiling Point: 98 °C (10 mmHg); Density: 0.8625 (15 °C/15 °C).

Identification

CAS Registry Number2349-13-5
PubChem CID61304
Molecular formulaC11H22O2
Molecular weight186.16 g/mol
IUPAC nameheptyl 2-methylpropanoate
InChIKeyRFDUMBPGZUIKOG-UHFFFAOYSA-N
UNII (FDA)FE997Z53QF
ChEBI IDCHEBI:179379
FEMA number2550
JECFA number190

Computed Descriptors

Molecular Weight186.29
XLogP34
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count8
Exact Mass186.161979940
Monoisotopic Mass186.161979940
Topological Polar Surface Area26.3
Heavy Atom Count13
Formal Charge0

Physical & Chemical Properties

Boiling Point212.00 °C. @ 760.00 mm Hg
Boiling Point98 °C (10 mmHg)
Density0.8625 (15 °C/15 °C)
Refractive Index1.417-1.421

Physical description & handling notes

  • colourless to pale yellow liquid/herbaceous, woody odour
  • insoluble in water; soluble in organic solvents
  • (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 summary2.5% (1 / 40)

GHS Hazard Classification

GHS notification summary2.5% (1 / 40)
Reported hazard statementsH315 (97.5%), H319 (97.5%), H335 (97.5%)

This chemical does not meet GHS hazard criteria for 2.5% (1 of 40) of reports.

H315 (97.5%): Causes skin irritation [Warning Skin corrosion/irritation]

Documented Uses

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

Synonyms

Heptyl 2-methylpropanoate; HEPTYL ISOBUTYRATE; 2349-13-5; Isobutyric acid, heptyl ester; Propanoic acid, 2-methyl-, heptyl ester; Heptyl iobutyrate; FEMA No. 2550; FE997Z53QF; EINECS 219-076-3; AI3-21506; DTXSID6062339; HEPTYL ISOBUTYRATE [FHFI]; RefChem:783740; DTXCID1036880; 219-076-3; Heptyl isobutanoate

Frequently Asked Questions

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

CAS 2349-13-5; molecular formula C11H22O2; molecular weight 186.16 g/mol.

What other names is heptyl isobutyrate known by?

Heptyl 2-methylpropanoate, HEPTYL ISOBUTYRATE, 2349-13-5, Isobutyric acid, heptyl ester, Propanoic acid, 2-methyl-, heptyl ester, Heptyl iobutyrate.

What is the regulatory status of heptyl isobutyrate?

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

Is heptyl isobutyrate classified as hazardous?

2.5% of GHS notifications report no hazard classification (1 of 40).

What are the key physical properties of heptyl isobutyrate?

Boiling Point: 212.00 °C. @ 760.00 mm Hg; Boiling Point: 98 °C (10 mmHg); Density: 0.8625 (15 °C/15 °C); Refractive Index: 1.417-1.421.

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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