CAS 764-42-1|Fumaronitrile
Introduction：Basic information about CAS 764-42-1|Fumaronitrile, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Fumaronitrile | ||
|---|---|---|---|
| CAS Number | 764-42-1 | Molecular Weight | 78.072 |
| Density | 1.0±0.1 g/cm3 | Boiling Point | 187.3±13.0 °C at 760 mmHg |
| Molecular Formula | C4H2N2 | Melting Point | 93-95 °C(lit.) |
| MSDS | ChineseUSA | Flash Point | 82.6±13.7 °C |
| Symbol | GHS06 | Signal Word | Danger |
Names
| Name | (E)-but-2-enedinitrile |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 1.0±0.1 g/cm3 |
|---|---|
| Boiling Point | 187.3±13.0 °C at 760 mmHg |
| Melting Point | 93-95 °C(lit.) |
| Molecular Formula | C4H2N2 |
| Molecular Weight | 78.072 |
| Flash Point | 82.6±13.7 °C |
| Exact Mass | 78.021797 |
| PSA | 47.58000 |
| LogP | -0.19 |
| Vapour Pressure | 0.6±0.4 mmHg at 25°C |
| Index of Refraction | 1.458 |
| InChIKey | KYPOHTVBFVELTG-OWOJBTEDSA-N |
| SMILES | N#CC=CC#N |
| Storage condition | 2-8°C |
| Stability | Stable. Incompatible with strong acids, strong bases, strong oxidizing agents, strong reducing agents. |
Toxicological Information
CHEMICAL IDENTIFICATION |
ACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 132 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 38 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 56 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
MUTATION DATA - TYPE OF TEST :
- Sex chromosome loss and nondisjunction
- TEST SYSTEM :
- Yeast - Saccharomyces cerevisiae
- DOSE/DURATION :
- 17 mg/L
- REFERENCE :
- MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 241,255,1990
- TYPE OF TEST :
- Sex chromosome loss and nondisjunction
- TEST SYSTEM :
- Yeast - Saccharomyces cerevisiae
- DOSE/DURATION :
- 17 mg/L
- REFERENCE :
- MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 241,255,1990
Safety Information
| Symbol | GHS06 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H301-H301 + H331-H331 |
| Precautionary Statements | P261-P301 + P310-P311 |
| Personal Protective Equipment | Eyeshields;Faceshields;Gloves;type P2 (EN 143) respirator cartridges |
| Hazard Codes | T:Toxic; |
| Risk Phrases | R23/24/25 |
| Safety Phrases | S36/37/39-S45 |
| RIDADR | UN 3439 6.1/PG 3 |
| WGK Germany | 3 |
| RTECS | LT2300000 |
| Packaging Group | II |
| Hazard Class | 6.1 |
Articles10
More Articles| Effect of dosing vehicle on the toxicity and metabolism of unsaturated aliphatic nitriles. J. Appl. Toxicol. 15(5) , 411-20, (1995) The effect of dosing vehicle on toxicity and metabolism of unsaturated aliphatic nitriles was investigated in male Sprague-Dawley rats. Five unsaturated aliphatic nitriles--acrylonitrile, methacryloni... | |
| Ultrafast excited state dynamics of the perylene radical cation generated upon bimolecular photoinduced electron transfer reaction. J. Phys. Chem. A 110(24) , 7547-53, (2006) The ultrafast ground state recovery (GSR) dynamics of the radical cation of perylene, Pe(*+), generated upon bimolecular photoinduced electron transfer in acetonitrile, has been investigated using pum... | |
| η1-Allylpalladium complexes with a tridentate PNP ligand with different phosphino groups. Dalton Trans. 41(40) , 12490-500, (2012) The iminodiphosphine 2-(PPh(2))C(6)H(4)-1-CH=NC(6)H(4)-2-(PPh(2)) (P-N-P') is used for the preparation of the complexes [Pd(η(1)-CHR(1)-CH=CR(2)R(3))(P-N-P')]BF(4) [R(1) = R(2) = R(3) = H: (1); R(1) =... |
Synonyms
| (2E)-But-2-endinitril |
| 2-Butenedinitrile,(E) |
| (2E)-2-Butenedinitrile |
| 2-Butenedinitrile,(2E) |
| trans-but-2-enedinitrile |
| Fumaric nitrile |
| Fumarodinitrile |
| 2-Butenedinitrile, (2E)- |
| MFCD00001928 |
| Fumaronitrile |
| But-2-enedinitrile |
| 1,2-dicyanoethylene |
| Furmaronitrile |
| EINECS 212-122-3 |
| (2E)-But-2-enedinitrile |
| trans-1,2-Dicyanoethylene |
