Introduction：Basic information about CAS 24309-48-6|Propargyl isothiocyanate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Propargyl isothiocyanate |
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| CAS Number | 24309-48-6 | Molecular Weight | 97.13830 |
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| Density | 1.06 g/cm3 | Boiling Point | 43ºC |
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| Molecular Formula | C4H3NS | Melting Point | / |
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| MSDS | / | Flash Point | 35.6ºC |
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Names
| Name | Propargyl isothiocyanate |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.06 g/cm3 |
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| Boiling Point | 43ºC |
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| Molecular Formula | C4H3NS |
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| Molecular Weight | 97.13830 |
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| Flash Point | 35.6ºC |
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| Exact Mass | 96.99860 |
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| PSA | 44.45000 |
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| LogP | 0.72240 |
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| Vapour Pressure | 4.76mmHg at 25°C |
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| Index of Refraction | 1.484 |
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| InChIKey | XCXOHPXTLZMKQJ-UHFFFAOYSA-N |
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| SMILES | C#CCN=C=S |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- XL2050000
- CHEMICAL NAME :
- Thiocyanic acid, 2-propynyl ester
- CAS REGISTRY NUMBER :
- 24309-48-6
- BEILSTEIN REFERENCE NO. :
- 1735709
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C4-H3-N-S
- MOLECULAR WEIGHT :
- 97.14
- WISWESSER LINE NOTATION :
- NCS2UU1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 4200 ug/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#09770
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Safety Information
| RIDADR | UN 2810 |
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| HS Code | 2930909090 |
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Customs
| HS Code | 2930909090 |
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| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Synonyms
