Introduction：Basic information about CAS 103181-72-2|Guaisteine, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Guaisteine |
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| CAS Number | 103181-72-2 | Molecular Weight | 341.44600 |
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| Density | 1.273 g/cm3 | Boiling Point | 510.5ºC at 760 mm |
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| Molecular Formula | C15H19NO4S2 | Melting Point | 72-76ºC |
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| MSDS | / | Flash Point | 262.5ºC |
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Names
| Name | S-[2-[2-[(2-methoxyphenoxy)methyl]-1,3-thiazolidin-3-yl]-2-oxoethyl] ethanethioate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.273 g/cm3 |
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| Boiling Point | 510.5ºC at 760 mm |
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| Melting Point | 72-76ºC |
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| Molecular Formula | C15H19NO4S2 |
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| Molecular Weight | 341.44600 |
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| Flash Point | 262.5ºC |
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| Exact Mass | 341.07600 |
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| PSA | 106.44000 |
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| LogP | 2.19310 |
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| Vapour Pressure | 1.54E-10mmHg at 25°C |
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| Index of Refraction | 1.583 |
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| InChIKey | DUTQZUMFFDWHBC-UHFFFAOYSA-N |
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| SMILES | COc1ccccc1OCC1SCCN1C(=O)CSC(C)=O |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- KI9443162
- CHEMICAL NAME :
- Ethanethioic acid, S-(2-(2-((2-methoxyphenoxy)methyl)-3-thiazolidinyl)-2 -oxoethyl) ester
- CAS REGISTRY NUMBER :
- 103181-72-2
- LAST UPDATED :
- 199603
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C15-H19-N-O4-S2
- MOLECULAR WEIGHT :
- 341.47
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >1 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 38,508,1995
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Synonyms
| Guaisteine |
| Guaisteinum |
| Guaisteina |
