Introduction：Basic information about CAS 1871-96-1|Sebaconitrile, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Sebaconitrile |
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| CAS Number | 1871-96-1 | Molecular Weight | 164.24700 |
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| Density | 0.915 g/mL at 20 °C(lit.) | Boiling Point | 199-200 °C(lit.) |
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| Molecular Formula | C10H16N2 | Melting Point | 7-8 °C(lit.) |
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| MSDS | / | Flash Point | >230 °F |
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Names
| Name | decanedinitrile |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 0.915 g/mL at 20 °C(lit.) |
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| Boiling Point | 199-200 °C(lit.) |
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| Melting Point | 7-8 °C(lit.) |
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| Molecular Formula | C10H16N2 |
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| Molecular Weight | 164.24700 |
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| Flash Point | >230 °F |
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| Exact Mass | 164.13100 |
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| PSA | 47.58000 |
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| LogP | 3.15436 |
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| Vapour Pressure | 0.000152mmHg at 25°C |
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| Index of Refraction | n20/D 1.447 |
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| InChIKey | DFJYZCUIKPGCSG-UHFFFAOYSA-N |
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| SMILES | N#CCCCCCCCCC#N |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- VS1500000
- CHEMICAL NAME :
- Sebaconitrile
- CAS REGISTRY NUMBER :
- 1871-96-1
- BEILSTEIN REFERENCE NO. :
- 1750739
- LAST UPDATED :
- 199710
- DATA ITEMS CITED :
- 5
- MOLECULAR FORMULA :
- C10-H16-N2
- MOLECULAR WEIGHT :
- 164.28
- WISWESSER LINE NOTATION :
- NC8CN
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 90,260,1947
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 165 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,905,1986
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Safety Information
| Hazard Codes | T:Toxic; |
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| Risk Phrases | R25;R36/37/38 |
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| Safety Phrases | S26-S36/37/39-S45 |
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| RIDADR | UN 3276 6.1/PG 3 |
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| WGK Germany | 3 |
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| RTECS | VS1500000 |
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| Packaging Group | III |
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| Hazard Class | 6.1 |
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| HS Code | 29269095 |
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Customs
| HS Code | 2926909090 |
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| Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
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Synonyms
| EINECS 217-494-0 |
| Sebacinsaeure-dinitril |
| Sebaconitrile |
| Decanedinitrile |
| 1,8-Dicyanooctane |
| Decandinitril |
| Octamethylene Dicyanide |
| MFCD00019900 |
| sebacic acid dinitrile |
