Ethyl 3-methylthiopropionate (CAS 13327-56-5) — formula C6H12O2S, molecular weight 148.06 g/mol; category organic chemicals.
| CAS Number | 13327-56-5 |
|---|---|
| Molecular Formula | C6H12O2S |
| Molecular Weight | 148.06 g/mol |
| Boiling Point | 196.00 to 197.00 °C. @ 760.00 mm Hg |
| LogP | 1.1 |
| Packaging | 25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation) |
| Category | Organic Chemicals |
Ethyl 3-methylthiopropionate is a carbon-based organic compound with CAS registry number 13327-56-5 and molecular formula C6H12O2S (molecular weight 148.06 g/mol), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 13327-56-5
Its molecular formula C6H12O2S comprises 6 C, 12 H, 2 O, 1 S atoms.
Also known as: Ethyl 3-methylthiopropionate · 3-甲硫基丙酸乙酯
Category: organic chemicals
The CAS registry number of Ethyl 3-methylthiopropionate is 13327-56-5.
Molecular formula C6H12O2S, molecular weight 148.06 g/mol.
It is also registered under: Ethyl 3-methylthiopropionate, 3-甲硫基丙酸乙酯.
Category: Organic Chemicals.
Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.
Independent reference data for Ethyl 3-methylthiopropionate (CAS 13327-56-5), compiled from public chemistry databases.
| CAS Registry Number | 13327-56-5 |
|---|---|
| PubChem CID | 61592 |
| Molecular formula | C6H12O2S |
| Molecular weight | 148.06 g/mol |
| IUPAC name | ethyl 3-methylsulfanylpropanoate |
| InChIKey | YSNWHRKJEKWJNY-UHFFFAOYSA-N |
| UNII (FDA) | 1AVT374NII |
| ChEBI ID | CHEBI:87503 |
| FEMA number | 3343 |
| JECFA number | 476 |
| Molecular Weight | 148.23 |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 148.05580079 |
| Monoisotopic Mass | 148.05580079 |
| Topological Polar Surface Area | 51.6 |
| Heavy Atom Count | 9 |
| Boiling Point | 196.00 to 197.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 89-91 °C (15 mm Hg) |
| Density | 1.030-1.035 |
| Refractive Index | 1.457-1.463 |
13327-56-5; Ethyl 3-(methylthio)propionate; Ethyl 3-(methylthio)propanoate; Ethyl 3-methylthiopropionate; Propanoic acid, 3-(methylthio)-, ethyl ester; ethyl 3-methylsulfanylpropanoate; FEMA No. 3343; 3-(Methylthio)propionic Acid Ethyl Ester; UNII-1AVT374NII; 1AVT374NII; EINECS 236-370-7; NSC 165650; NSC-165650; DTXSID2065414; CHEBI:87503; FEMA 3343
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Cabbage, Caramel, Grass, Menthol No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 97.1% (168 / 173) |
| GHS notification summary | 97.1% (168 / 173) |
|---|
This chemical does not meet GHS hazard criteria for 97.1% (168 of 173) of all reports.
Reported as not meeting GHS hazard criteria by 168 of 173 companies (only 2.9% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
Ethyl 3-methylthiopropionate is identified by CAS 13327-56-5, molecular formula C6H12O2S and molecular weight 148.06 g/mol. UNII 1AVT374NII; ChEBI 87503; InChIKey YSNWHRKJEKWJNY-UHFFFAOYSA-N. Boiling Point: 196.00 to 197.00 °C. @ 760.00 mm Hg; Boiling Point: 89-91 °C (15 mm Hg); Density: 1.030-1.035.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-甲硫基丙酸乙酯