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THIOGERANIOL

CAS 39067-80-6C10H18SMW 170.11 g/mol

THIOGERANIOL (CAS No. 39067-80-6) 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 Number39067-80-6
Molecular FormulaC10H18S
Molecular Weight170.11 g/mol
Boiling Point58 °C (0.35 mm Hg)
LogP3.9
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 THIOGERANIOL?

The CAS number of THIOGERANIOL is 39067-80-6.

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 THIOGERANIOL?

Main applications include Organic Chemicals;Flavors.

How do I buy THIOGERANIOL 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

THIOGERANIOL is identified by CAS 39067-80-6, molecular formula C10H18S and molecular weight 170.11 g/mol. UNII Y6E61O3D5Y; ChEBI 143703; InChIKey FACAUSJJVBMWLV-JXMROGBWSA-N. Boiling Point: 58 °C (0.35 mm Hg); Density: 0.903-0.921; Refractive Index: 1.503-1.513.

Identification

CAS Registry Number39067-80-6
PubChem CID6365572
Molecular formulaC10H18S
Molecular weight170.11 g/mol
IUPAC name(2E)-3,7-dimethylocta-2,6-diene-1-thiol
InChIKeyFACAUSJJVBMWLV-JXMROGBWSA-N
UNII (FDA)Y6E61O3D5Y
ChEBI IDCHEBI:143703
FEMA number3472
JECFA number524

Computed Descriptors

Molecular Weight170.32
XLogP33.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass170.11292175
Monoisotopic Mass170.11292175
Topological Polar Surface Area1
Heavy Atom Count11
Formal Charge0

Physical & Chemical Properties

Boiling Point58 °C (0.35 mm Hg)
Density0.903-0.921
Refractive Index1.503-1.513

Physical description & handling notes

  • yellow to orange liquid
  • (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 summary69.1% (85 / 123)

GHS Hazard Classification

GHS notification summary69.1% (85 / 123)
Reported hazard statementsH226 (21.1%), H317 (20.3%), H335 (10.6%)

This chemical does not meet GHS hazard criteria for 69.1% (85 of 123) of all reports.

H226 (21.1%): Flammable liquid and vapor [Warning Flammable liquids]

Documented Uses

  • Flavoring Agents -> JECFA Flavorings Index
  • Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
  • Information on 1 consumer products that contain 2,6-Octadiene-1-thiol, 3,7-dimethyl- in the following categories is provided:
  • 2,6-Octadiene-1-thiol, 3,7-dimethyl-: ACTIVE
  • 2,6-Octadiene-1-thiol, 3,7-dimethyl-, (2E)-: ACTIVE

Synonyms

Thiogeraniol; 39067-80-6; (E)-3,7-Dimethylocta-2,6-diene-1-thiol; (2E)-3,7-dimethylocta-2,6-diene-1-thiol; Geranyl mercaptan; FEMA No. 3472; UNII-Y6E61O3D5Y; Y6E61O3D5Y; EINECS 254-269-6; 2,6-Octadiene-1-thiol, 3,7-dimethyl-, (E)-; THIOGERANIOL [FHFI]; DTXSID3052064; 3,7-Dimethyl-2,6-octadiene-1-thiol, (E)-; CHEBI:143703; RefChem:189533; DTXCID8030631

Frequently Asked Questions

What are the CAS number and molecular formula of THIOGERANIOL?

CAS 39067-80-6; molecular formula C10H18S; molecular weight 170.11 g/mol.

What other names is THIOGERANIOL known by?

Thiogeraniol, 39067-80-6, (E)-3,7-Dimethylocta-2,6-diene-1-thiol, (2E)-3,7-dimethylocta-2,6-diene-1-thiol, Geranyl mercaptan, FEMA No. 3472.

What is the regulatory status of THIOGERANIOL?

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

Is THIOGERANIOL classified as hazardous?

69.1% of GHS notifications report no hazard classification (85 of 123).

What are the key physical properties of THIOGERANIOL?

Boiling Point: 58 °C (0.35 mm Hg); Density: 0.903-0.921; Refractive Index: 1.503-1.513.

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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