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Methyl thiofuroate

CAS 13679-61-3C6H6O2SMW 142.18

Methyl thiofuroate (CAS 13679-61-3) — formula C6H6O2S, molecular weight 142.18; category organic chemicals.

Product Overview

CAS Number13679-61-3
Molecular FormulaC6H6O2S
Molecular Weight142.18
Boiling Point63.00 °C. @ 2.00 mm Hg
LogP1.4
CategoryOrganic Chemicals

Technical Profile

What this product is

Methyl thiofuroate is a carbon-based organic compound with CAS registry number 13679-61-3 and molecular formula C6H6O2S (molecular weight 142.18), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 13679-61-3

Its molecular formula C6H6O2S comprises 6 C, 6 H, 2 O, 1 S atoms.

Also known as: Methyl thiofuroate · 硫代糠酸甲酯

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of Methyl thiofuroate?

The CAS registry number of Methyl thiofuroate is 13679-61-3.

What is the molecular formula and molecular weight of Methyl thiofuroate?

Molecular formula C6H6O2S, molecular weight 142.18.

What other names is Methyl thiofuroate known by?

It is also registered under: Methyl thiofuroate, 硫代糠酸甲酯.

Which category does Methyl thiofuroate belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for Methyl thiofuroate (CAS 13679-61-3), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number13679-61-3
PubChem CID61662
Molecular formulaC6H6O2S
IUPAC nameS-methyl furan-2-carbothioate
UNII (FDA)9H9BCF87R7
FEMA number3311
JECFA number1083

Computed descriptors

Molecular Weight142.18
XLogP31.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass142.00885060
Monoisotopic Mass142.00885060
Topological Polar Surface Area55.5
Heavy Atom Count9

Physicochemical values on record

Boiling Point63.00 °C. @ 2.00 mm Hg
Boiling Point92-93 °C (11mmHg); 62-63 °C (2 mmHg)
Density1.230-1.241
Refractive Index1.567-1.573

Documented uses on record

    Flavoring Agents -> JECFA Flavorings IndexFlavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

    Synonyms and trade names

    Methyl 2-thiofuroate; 13679-61-3; S-Methyl 2-furancarbothioate; Methyl thiofuroate; S-Methyl thiofuroate; Methylthiol furoate; 2-Furancarbothioic acid, S-methyl ester; 2-Furoic acid, thio-, S-methyl ester; Methyl thio-2-furoate; S-Methyl thio-2-furoate; FEMA No. 3311; EINECS 237-177-0; 9H9BCF87R7; METHYL 2-THIOFUROATE [FHFI]; DTXSID3065582; furan-2-yl(methylsulfanyl)methanone

    Regulatory listings held on file

    Regulatory & Food ContactEU Flavoring substances
    FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
    Flavoring Agents
    FLAVOURING_AGENT: Flavouring Agent
    Savory
    No safety concern at current levels of intake when used as a flavouring agent
    GHS notification summary10.3% (149 / 1447)

    GHS hazard classification

    GHS notification summary10.3% (149 / 1447)
    Reported hazard statementsH302 (89.7%)

    This chemical does not meet GHS hazard criteria for 10.3% (149 of 1447) of reports.

    H302 (89.7%): Harmful if swallowed [Warning Acute toxicity, oral]

    What the public record says

    Methyl thiofuroate · CAS 13679-61-3 · C6H6O2S. UNII 9H9BCF87R7. Boiling Point: 63.00 °C. @ 2.00 mm Hg; Boiling Point: 92-93 °C (11mmHg); 62-63 °C (2 mmHg); Density: 1.230-1.241.

    Physical description and handling notes

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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Supplier: Jinan Shenghe Chemical Co., Ltd.

中文页面: 硫代糠酸甲酯

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