Introduction：Basic information about CAS 34424-44-7|isothiocyanic acid 3-buten-1-yl ester, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | isothiocyanic acid 3-buten-1-yl ester |
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| CAS Number | 34424-44-7 | Molecular Weight | 113.18100 |
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| Density | 0.9g/cm3 | Boiling Point | 168.6ºC at 760mmHg |
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| Molecular Formula | C5H7NS | Melting Point | / |
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| MSDS | USA | Flash Point | / |
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Names
| Name | isothiocyanic acid 3-buten-1-yl ester |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.9g/cm3 |
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| Boiling Point | 168.6ºC at 760mmHg |
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| Molecular Formula | C5H7NS |
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| Molecular Weight | 113.18100 |
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| Exact Mass | 113.03000 |
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| PSA | 44.45000 |
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| LogP | 1.66530 |
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| Index of Refraction | 1.484 |
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| InChIKey | XDDPFUCCKIMFOG-ONEGZZNKSA-N |
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| SMILES | CCC=CN=C=S |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- NX8420200
- CHEMICAL NAME :
- Isothiocyanic acid, butenyl ester
- CAS REGISTRY NUMBER :
- 34424-44-7
- LAST UPDATED :
- 199312
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C5-H7-N-S
- MOLECULAR WEIGHT :
- 113.19
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 800 mg/kg
- SEX/DURATION :
- female 12-19 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus) Reproductive - Specific Developmental Abnormalities - musculoskeletal system
- REFERENCE :
- NAHRAR Nahrung. Chemistry, Biochemistry, Microbiology, Technology, Nutrition. (Akademie-Verlag GmBH, Postfach 1233, Berlin DDR-1086, Ger. Dem. Rep.) V.1- 1957- Volume(issue)/page/year: 36,490,1992
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Safety Information
Customs
| HS Code | 2929109000 |
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| Summary | 2929109000. other isocyanates. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Synonyms
| 3-BUTENYL ISOTHIOCYANATE |
| 3-BUTEN-1-YL ISOTHIOCYANATE |
| 1-BUTENE-4-ISOTHIOCYANATE |
| isothiocyanicacid,butenylester |
| BUT-2-ENYLISOTHIOCYANATE |
| isocyanicacidbutenylester |
| BUTEN-3-YLISOTHIOCYANATE |
| butenylisothiocyanat |
| butenylisothiocyanate |
| Butenylisothiocyanat [german] |
