CAS 4892-02-8|Methyl 2-sulfanylbenzoate
| Common Name | Methyl 2-sulfanylbenzoate | ||
|---|---|---|---|
| CAS Number | 4892-02-8 | Molecular Weight | 168.213 |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 261.9±23.0 °C at 760 mmHg |
| Molecular Formula | C8H8O2S | Melting Point | / |
| MSDS | ChineseUSA | Flash Point | 161.5±10.5 °C |
| Symbol | GHS07 | Signal Word | Warning |
Names
| Name | methyl thiosalicylate |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 261.9±23.0 °C at 760 mmHg |
| Molecular Formula | C8H8O2S |
| Molecular Weight | 168.213 |
| Flash Point | 161.5±10.5 °C |
| Exact Mass | 168.024506 |
| PSA | 65.10000 |
| LogP | 2.69 |
| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
| Index of Refraction | 1.574 |
| InChIKey | BAQGCWNPCFABAY-UHFFFAOYSA-N |
| SMILES | COC(=O)c1ccccc1S |
Toxicological Information
CHEMICAL IDENTIFICATION |
ACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 50 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD277-689
Safety Information
| Symbol | GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302-H312-H315-H319-H332-H335 |
| Precautionary Statements | P261-P280-P305 + P351 + P338 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xn:Harmful; |
| Risk Phrases | R20/21/22;R36/37/38 |
| Safety Phrases | S26-S37/39 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| RTECS | DH3500000 |
| HS Code | 2930909090 |
Customs
| HS Code | 2930909090 |
|---|---|
| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
Articles5
More Articles| Synthesis and in vitro/in vivo evaluation of novel mono- and trivalent technetium-99m labeled ghrelin peptide complexes as potential diagnostic radiopharmaceuticals. Nucl. Med. Biol. 42(1) , 28-37, (2014) Ghrelin is an endogenous hormone present in blood. It is released from the oxyntic cells (X/A-like cells) of the stomach and fundus and can exist in two forms: as an acylated and des-acylated ghrelin.... | |
| A chiral thioxanthone as an organocatalyst for enantioselective [2+2] photocycloaddition reactions induced by visible light. Angew. Chem. Int. Ed. Engl. 53(17) , 4368-71, (2014) Thioxanthone 1, which was synthesized in a concise fashion from methyl thiosalicylate, exhibits a significant absorption in the visible light region. It allows for an efficient enantioselective cataly... | |
| Novel alternative for the N-S bond formation and its application to the synthesis of benzisothiazol-3-ones. Org. Lett. 8(21) , 4811-3, (2006) [reaction: see text] The synthesis of a series of benzisothiazolone derivatives starting from the readily available methyl thiosalicylate is presented. The key cyclization step features the formation ... |
Synonyms
| Methyl 2-Mercaptobenzoate |
| 2-Mercaptobenzoic Acid Methyl Ester |
| Thiosalicylic Acid Methyl Ester |
| Methyl 2-sulfanylbenzoate |
| Methyl thiosalicylate |
| Benzoic acid, 2-mercapto-, methyl ester |
| EINECS 232-189-9 |
| MFCD00060678 |
