Introduction:Basic information about CAS 4829-04-3|1,3-dithiolane, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1,3-dithiolane |
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| CAS Number | 4829-04-3 | Molecular Weight | 106.21000 |
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| Density | 1.235 | Boiling Point | 83-84°C 35mm |
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| Molecular Formula | C3H6S2 | Melting Point | 68ºC |
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| MSDS | USA | Flash Point | 68°C |
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Names
| Name | 1,3-dithiolane |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.235 |
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| Boiling Point | 83-84°C 35mm |
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| Melting Point | 68ºC |
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| Molecular Formula | C3H6S2 |
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| Molecular Weight | 106.21000 |
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| Flash Point | 68°C |
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| Exact Mass | 105.99100 |
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| PSA | 50.60000 |
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| LogP | 1.42390 |
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| Index of Refraction | 1.599 |
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| InChIKey | IMLSAISZLJGWPP-UHFFFAOYSA-N |
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| SMILES | C1CSCS1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- JP0511000
- CHEMICAL NAME :
- 1,3-Dithiolane
- CAS REGISTRY NUMBER :
- 4829-04-3
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C3-H6-S2
- MOLECULAR WEIGHT :
- 106.21
- WISWESSER LINE NOTATION :
- T5S CSTJ
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 900 mg/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
| Safety Phrases | S23-S24/25 |
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| RIDADR | 3334 |
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| RTECS | JP0511000 |
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| HS Code | 2934999090 |
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Customs
| HS Code | 2934999090 |
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| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Articles10
More Articles
| Cationic cyclization of 2-alkenyl-1,3-dithiolanes: diastereoselective synthesis of trans-decalins. J. Org. Chem. 76(9) , 3274-85, (2011) An unprecedented and highly diastereoselective 6-endo-trig cyclization of 2-alkenyl-1,3-dithiolanes has been developed yielding trans-decalins, an important scaffold present in numerous di- and triter... | |
| gem-Difluorination of 2,2-diaryl-1,3-dithiolanes by Selectfluor and pyridinium polyhydrogen fluoride. Chem. Commun. (Camb.) , 654, (2005) 2,2-diaryl-1,3-dithiolanes, readily obtainable from diaryl ketones, were transformed into the corresponding gem-difluoro compounds using a novel reagent combination involving Selectfluor and pyridiniu... | |
| Alpha-keto amide peptides: a synthetic strategy to resin-bound peptide isosteres for protease inhibitor screening on solid support. J. Comb. Chem. 6(2) , 181-95, (2004) A synthetic strategy for the formation of resin-bound internal alpha-keto amide peptides suitable for protease inhibitor screening on solid support is presented. This general approach is based on the ... | |
Synonyms
| 1,3-Dithiacyclopentane |
| 1,3-DITHIOLANE |
| MFCD00041425 |
| [1,3]Dithiolan |
| 1',3'-dithiolane |