S-甲基4-甲基硫代戊酸酯，CAS 登记号 61122-71-2，由济南圣和化工有限公司现货供应，可提供纯度 按批次COA提供(不公开发布) 的规格，下游主要用于有机化学品。支持样品与小批量试用，批量价格请联系我们获取，验收以批次 COA 为准。
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S-methyl 4-methylpentanethioate · CAS 61122-71-2 · C7H14OS. UNII 011EVD3QYF. Boiling Point: 110.00 to 112.00 °C. @ 20.00 mm Hg; Boiling Point: 110-112 °C (20 mm Hg); Density: 0.832-0.837.
| CAS Registry Number | 61122-71-2 |
|---|---|
| PubChem CID | 46779070 |
| Molecular formula | C7H14OS |
| IUPAC name | S-methyl 4-methylpentanethioate |
| UNII (FDA) | 011EVD3QYF |
| FEMA number | 3867 |
| JECFA number | 488 |
| Molecular Weight | 146.25 |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 4 |
| Exact Mass | 146.07653624 |
| Monoisotopic Mass | 146.07653624 |
| Topological Polar Surface Area | 42.4 |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Boiling Point | 110.00 to 112.00 °C. @ 20.00 mm Hg |
|---|---|
| Boiling Point | 110-112 °C (20 mm Hg) |
| Density | 0.832-0.837 |
| Refractive Index | 1.472-1.478 |
| 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 |
|---|
| Reported hazard statements | H226 (100%) |
|---|
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
S-Methyl 4-methylpentanethioate; 61122-71-2; 011EVD3QYF; Pentanethioic acid, 4-methyl-, S-methyl ester; FEMA NO. 3867; DTXSID20210008; 4-METHYL-1-(METHYLSULFANYL)PENTAN-1-ONE; S-METHYL 4-METHYLPENTANETHIOATE [FHFI]; RefChem:884255; DTXCID80132499; Pentanethioic acid, 4-methyl, S-methyl ester; 612-089-9; UNII-011EVD3QYF; S-Methyl4-methylpentanethioate; SCHEMBL20378736; FEMA 3867
CAS 61122-71-2; molecular formula C7H14OS; molecular weight — g/mol.
S-Methyl 4-methylpentanethioate, 61122-71-2, 011EVD3QYF, Pentanethioic acid, 4-methyl-, S-methyl ester, FEMA NO. 3867, DTXSID20210008.
Documented regulatory listings: EU Flavoring substances; FDA Substance added to food: FLAVORING AGENT OR ADJUVANT; Flavoring Agents.
Hazard statements reported: H226.
Boiling Point: 110.00 to 112.00 °C. @ 20.00 mm Hg; Boiling Point: 110-112 °C (20 mm Hg); Density: 0.832-0.837; Refractive Index: 1.472-1.478.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.