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Thioacrylic propionate

CAS 41820-22-8C6H10OSMW 130.21

Thioacrylic propionate (CAS 41820-22-8) — formula C6H10OS, molecular weight 130.21; category organic chemicals.

Product Overview

CAS Number41820-22-8
Molecular FormulaC6H10OS
Molecular Weight130.21
Boiling Point150.00 to 151.00 °C. @ 760.00 mm Hg
LogP1.8
ApplicationsUse Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index
CategoryOrganic Chemicals

Applications

Documented applications: Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index.

Technical Profile

What this product is

Thioacrylic propionate is a carbon-based organic compound with CAS registry number 41820-22-8 and molecular formula C6H10OS (molecular weight 130.21), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 41820-22-8

Its molecular formula C6H10OS comprises 6 C, 10 H, 1 O, 1 S atoms.

Also known as: Thioacrylic propionate · 硫代丙烯酸丙酸酯

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of Thioacrylic propionate?

The CAS registry number of Thioacrylic propionate is 41820-22-8.

What is the molecular formula and molecular weight of Thioacrylic propionate?

Molecular formula C6H10OS, molecular weight 130.21.

What other names is Thioacrylic propionate known by?

It is also registered under: Thioacrylic propionate, 硫代丙烯酸丙酸酯.

What are the documented applications of Thioacrylic propionate?

Recorded applications: Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index.

Which category does Thioacrylic propionate belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for Thioacrylic propionate (CAS 41820-22-8), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number41820-22-8
PubChem CID61995
Molecular formulaC6H10OS
IUPAC nameS-prop-2-enyl propanethioate
UNII (FDA)95HUD1BW6G
FEMA number3329
JECFA number490

Computed descriptors

Molecular Weight130.21
XLogP31.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass130.04523611
Monoisotopic Mass130.04523611
Topological Polar Surface Area42.4
Heavy Atom Count8

Physicochemical values on record

Boiling Point150.00 to 151.00 °C. @ 760.00 mm Hg
Boiling Point151 °C
Density0.898-0.902
Refractive Index1.475-1.485

Documented uses on record

  • Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
  • Flavoring Agents -> JECFA Flavorings Index

Synonyms and trade names

Allyl thiopropionate; S-Allyl thiopropionate; S-2-Propenyl propanethioate; Thioacrylic propionate; 95HUD1BW6G; Propanethioic acid, S-2-propenyl ester; FEMA No. 3329; UNII-95HUD1BW6G; 1-(prop-2-en-1-ylsulfanyl)propan-1-one; ALLYL THIOPROPIONATE [FHFI]; PROPANETHIOIC ACID, S-2-PROPEN-1-YL ESTER; RefChem:110894; 620-617-4; GKRISGLFPMFKSX-UHFFFAOYSA-N; 41820-22-8; S-Allyl propanethioate

Regulatory listings held on file

Regulatory & Food ContactEU Flavoring substances
FDA Substance added to food: FLAVORING AGENT OR ADJUVANT, PH CONTROL AGENT
Flavoring Agents
FLAVOURING_AGENT: Flavouring Agent
Savory
No safety concern at current levels of intake when used as a flavouring agent

What the public record says

Thioacrylic propionate · CAS 41820-22-8 · C6H10OS. UNII 95HUD1BW6G. Boiling Point: 150.00 to 151.00 °C. @ 760.00 mm Hg; Boiling Point: 151 °C; Density: 0.898-0.902.

Physical description and handling notes

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

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