2-(Methylthio) ethanol (CAS 5271-38-5) — formula C3H8OS, molecular weight 92.03 g/mol.
2-(Methylthio) ethanol is a chemical compound with CAS registry number 5271-38-5 and molecular formula C3H8OS (molecular weight 92.03 g/mol).
CAS number: 5271-38-5
Its molecular formula C3H8OS comprises 3 C, 8 H, 1 O, 1 S atoms.
Also known as: 2-(Methylthio) ethanol · 2-(Methylthio)ethanol
The CAS registry number of 2-(Methylthio) ethanol is 5271-38-5.
Molecular formula C3H8OS, molecular weight 92.03 g/mol.
It is also registered under: 2-(Methylthio) ethanol, 2-(Methylthio)ethanol.
Public-database records for 2-(Methylthio) ethanol (CAS 5271-38-5), reproduced here for independent cross-checking.
| GHS notification summary | 91.9% (91 / 99) |
|---|
This chemical does not meet GHS hazard criteria for 91.9% (91 of 99) of all reports.
Reported as not meeting GHS hazard criteria by 91 of 99 companies (only 8.1% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
| Regulatory & Food Contact | EU 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 summary | 91.9% (91 / 99) |
| 沸点 | 169.00 to 171.00 °C. @ 760.00 mm Hg |
|---|---|
| 沸点 | 169-171 °C |
| 密度 | 1.055-1.065 (20 °C) |
| 折射率 | 1.490-1.498 |
| CAS Registry Number | 5271-38-5 |
|---|---|
| PubChem CID | 78925 |
| 分子式 | C3H8OS |
| 分子量 | 92.03 g/mol |
| IUPAC 名称 | 2-methylsulfanylethanol |
| InChIKey | WBBPRCNXBQTYLF-UHFFFAOYSA-N |
| UNII(FDA) | 5K6TOE95UY |
| ChEBI 编号 | CHEBI:63861 |
| FEMA 编号 | 4004 |
| JECFA 编号 | 1297 |
2-(Methylthio)ethanol; 5271-38-5; Ethanol, 2-(methylthio)-; 2-methylthioethanol; Methylthioethanol; 2-Methylmercaptoethanol; 2-Hydroxyethyl methyl sulfide; 2-(Methylsulfanyl)ethanol; 2-(methylsulfanyl)ethan-1-ol; Methyl 2-hydroxyethyl sulfide; Hydroxyethyl methyl sulfide; S-Methylmercaptoethanol; beta-Methylmercaptoethanol; beta-Hydroxyethyl methyl sulfide; 1-Hydroxy-2-(methylthio)-ethane; beta-(Methylthio)ethanol
| 分子量 | 92.16 |
|---|---|
| XLogP3 | 0.2 |
| 氢键供体数 | 1 |
| 氢键受体数 | 2 |
| 可旋转键数 | 2 |
| 精确质量 | 92.02958605 |
| 单同位素质量 | 92.02958605 |
| 拓扑极性表面积 | 45.5 |
| 重原子数 | 5 |
| 形式电荷 | 0 |
2-(Methylthio) ethanol is identified by CAS 5271-38-5, molecular formula C3H8OS and molecular weight 92.03 g/mol. UNII 5K6TOE95UY; ChEBI 63861; InChIKey WBBPRCNXBQTYLF-UHFFFAOYSA-N. 沸点: 169.00 to 171.00 °C. @ 760.00 mm Hg; 沸点: 169-171 °C; 密度: 1.055-1.065 (20 °C).
Source: PubChem / Wikidata; the batch COA governs where values differ.
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