Methylthiomethyl butyrate (CAS 74758-93-3) — formula C6H12O2S, molecular weight 148.06 g/mol; category organic chemicals.
| CAS Number | 74758-93-3 |
|---|---|
| Molecular Formula | C6H12O2S |
| Molecular Weight | 148.06 g/mol |
| Boiling Point | 182.00 to 183.00 °C. @ 760.00 mm Hg |
| LogP | 1.7 |
| Category | Organic Chemicals |
Methylthiomethyl butyrate is a carbon-based organic compound with CAS registry number 74758-93-3 and molecular formula C6H12O2S (molecular weight 148.06 g/mol), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 74758-93-3
Its molecular formula C6H12O2S comprises 6 C, 12 H, 2 O, 1 S atoms.
Also known as: Methylthiomethyl butyrate · 奶油酯
Category: organic chemicals
The CAS registry number of Methylthiomethyl butyrate is 74758-93-3.
Molecular formula C6H12O2S, molecular weight 148.06 g/mol.
It is also registered under: Methylthiomethyl butyrate, 奶油酯.
Category: Organic Chemicals.
Independent reference data for Methylthiomethyl butyrate (CAS 74758-93-3), compiled from public chemistry databases.
| CAS 号 | 74758-93-3 |
|---|---|
| PubChem CID | 3018539 |
| 分子式 | C6H12O2S |
| 分子量 | 148.06 g/mol |
| IUPAC 名称 | methylsulfanylmethyl butanoate |
| InChIKey | PGAUNUCMBMQPFT-UHFFFAOYSA-N |
| UNII（FDA） | 9PF86RKU3Z |
| ChEBI 编号 | CHEBI:193665 |
| FEMA 编号 | 3879 |
| JECFA 编号 | 473 |
| Molecular Weight | 148.23 |
|---|---|
| XLogP3 | 1.7 |
| 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 | 182.00 to 183.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 94-96 °C (15 mm Hg) |
| Density | 0.943-0.948 |
| Refractive Index | 1.454-1.464 |
Methylthiomethyl butyrate; 74758-93-3; (Methylthio)methyl butyrate; Methyl 2-methylthiobutyrate; (methylsulfanyl)methyl butanoate; methyl thiomethyl butyrate; 9PF86RKU3Z; EINECS 277-989-2; Butanoic acid, (methylthio)methyl ester; FEMA NO. 3879; DTXSID60868320; METHYLTHIOMETHYL BUTYRATE [FHFI]; RefChem:818720; DTXCID00816441; 277-989-2; methylsulfanylmethyl butanoate
| 法规与食品接触 | 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 |
|---|
| 已通报的危害声明 | H302 |
|---|
奶油酯 的 CAS 号为 74758-93-3，分子式 C6H12O2S，分子量 148.06 g/mol。 UNII 9PF86RKU3Z; ChEBI 193665; InChIKey PGAUNUCMBMQPFT-UHFFFAOYSA-N. Boiling Point: 182.00 to 183.00 °C. @ 760.00 mm Hg; Boiling Point: 94-96 °C (15 mm Hg); Density: 0.943-0.948.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 奶油酯