Introduction：Basic information about CAS 22068-57-1|2-(4-HYDROXYPHENYL)-2-METHYL-1,3-DITHIOLAN, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-(4-HYDROXYPHENYL)-2-METHYL-1,3-DITHIOLAN |
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| CAS Number | 22068-57-1 | Molecular Weight | 212.33200 |
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| Density | 1.258g/cm3 | Boiling Point | 365.7ºC at 760mmHg |
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| Molecular Formula | C10H12OS2 | Melting Point | / |
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| MSDS | / | Flash Point | 177.8ºC |
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Names
| Name | 4-(2-methyl-1,3-dithiolan-2-yl)phenol |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.258g/cm3 |
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| Boiling Point | 365.7ºC at 760mmHg |
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| Molecular Formula | C10H12OS2 |
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| Molecular Weight | 212.33200 |
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| Flash Point | 177.8ºC |
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| Exact Mass | 212.03300 |
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| PSA | 70.83000 |
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| LogP | 3.04490 |
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| Vapour Pressure | 7.31E-06mmHg at 25°C |
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| Index of Refraction | 1.644 |
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| InChIKey | QTPANKHZSIPRCL-UHFFFAOYSA-N |
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| SMILES | CC1(c2ccc(O)cc2)SCCS1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- SL9550000
- CHEMICAL NAME :
- Phenol, p-(2-methyl-1,3-dithiolan-2-yl)-
- CAS REGISTRY NUMBER :
- 22068-57-1
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C10-H12-O-S2
- MOLECULAR WEIGHT :
- 212.34
- WISWESSER LINE NOTATION :
- T5S CSTJ B1 BR DQ
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 17,235,1982
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Safety Information
| Hazard Codes | Xi: Irritant; |
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Synonyms
| 2-methyl-2-(4-hydroxyphenyl)-1,3-dithiolane |
| 2-(2-METHYLPROP-2-EN-1-YL)BROMOBENZENE |
| p-(2-Methyl-1,3-dithiolan-2-yl)phenol |
| methyldithiolanylbenzenol |
| 2-(4-hydroxy-2-phenyl)-1,3-dithiolane |
| Phenol,p-(2-methyl-1,3-dithiolan-2-yl) |
