硫代苯甲酸甲酯，CAS 登记号 5925-68-8，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，下游主要用于食用香精。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 benzothioate is identified by CAS 5925-68-8, molecular formula C8H8OS and molecular weight 152.03 g/mol. UNII TV2YT5FVUQ; ChEBI 169501; InChIKey RQVWTMCUTHKGCM-UHFFFAOYSA-N. Boiling Point: 121.00 to 122.00 °C. @ 22.00 mm Hg; Boiling Point: 121-122 °C (22 mm Hg); Density: 0.826-0.836.
| CAS Registry Number | 5925-68-8 |
|---|---|
| PubChem CID | 80024 |
| Molecular formula | C8H8OS |
| Molecular weight | 152.03 g/mol |
| IUPAC name | S-methyl benzenecarbothioate |
| InChIKey | RQVWTMCUTHKGCM-UHFFFAOYSA-N |
| UNII (FDA) | TV2YT5FVUQ |
| ChEBI ID | CHEBI:169501 |
| FEMA number | 3857 |
| JECFA number | 504 |
| Molecular Weight | 152.22 |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 152.02958605 |
| Monoisotopic Mass | 152.02958605 |
| Topological Polar Surface Area | 42.4 |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Boiling Point | 121.00 to 122.00 °C. @ 22.00 mm Hg |
|---|---|
| Boiling Point | 121-122 °C (22 mm Hg) |
| Density | 0.826-0.836 |
| Refractive Index | 1.574-1.580 |
| 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 | H302 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
S-Methyl benzenecarbothioate; S-Methyl thiobenzoate; (S)-Methyl thiobenzoate; S-methyl benzothioate; Thiobenzoic acid S-methyl ester; methyl thiobenzoate; Benzenecarbothioic acid, S-methyl ester; (METHYLSULFANYL)(PHENYL)METHANONE; Benzoic acid, thio-, S-methyl ester; TV2YT5FVUQ; UNII-TV2YT5FVUQ; methylthiobenzoate; EINECS 227-656-2; methylthiobenzoic acid; thiobenzoic acid methyl ester; METHANETHIOL, BENZOATE
CAS 5925-68-8; molecular formula C8H8OS; molecular weight 152.03 g/mol.
S-Methyl benzenecarbothioate, S-Methyl thiobenzoate, (S)-Methyl thiobenzoate, S-methyl benzothioate, Thiobenzoic acid S-methyl ester, methyl thiobenzoate.
Documented regulatory listings: EU Flavoring substances; FDA Substance added to food: FLAVORING AGENT OR ADJUVANT; Flavoring Agents.
Hazard statements reported: H302.
Boiling Point: 121.00 to 122.00 °C. @ 22.00 mm Hg; Boiling Point: 121-122 °C (22 mm Hg); Density: 0.826-0.836; Refractive Index: 1.574-1.580.
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.