HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Acrylonitrile

Identifikatoren & physikalische Daten
| CAS No. | 107-13-1 |
|---|---|
| Summenformel | C3H3N |
| Durchschnittliche Molmasse | 53,06 g/mol |
| Monoisotopische Masse | 53,0265491 g/mol |
| SMILES | C=CC#N |
| InChIKey | NLHHRLWOUZZQLW-UHFFFAOYSA-N |
| PubChem CID | 7855 |
| ChEMBL | CHEMBL445612 |
| ChEBI | CHEBI:28217 |
| EC No. | 203-466-5 |
| DTXSID | DTXSID5020029 |
Chemische & physikalische Eigenschaften
| XLogP | 0,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 23,8 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 1 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 4 |
| Formalladung | 0 |
| Komplexität | 54 |
| pH | pH = 6.0-7.5 |
| LogP (Verteilungskoeffizient) | log Kow = 0.25 |
| Geruch | Practically odorless, or with a very slight odor of peach kernelsSweet odorIrritating odorUnpleasant odorOnion, garlic, pungent |
| Dichte | 0.8004 at 77 °F (EPA, 1998) - Less dense than waterwill float0.8007 at 25 °CRelative density (water = 1): 0.80.810.806 @ 20°C |
| Viscosity | 0.34 sq mm/s at 25 °C |
| Color/Form | Clear, colorless liquid at room temperatureColorless to pale-yellow liquid |
| Löslichkeit | 10 to 50 mg/mL at 70.9 °F (NTP, 1992)Solubility of water in acrylonitrile: 3.1 parts water/100 parts acrylonitrileIn water, 7.45X10+4 mg/L at 25 °CVery soluble in ethanol, acetone, benzene, etherAcrylonitrile is ... miscible with ethanol, carbon tetrachloride, ethyl acetate, ethylene cyanohydrin, liquid carbon dioxide, ... toluene, petroleum ether, and xylene.Solubility in water, g/100ml at 20 °C: 7slightly soluble |
| Corrosivity | Attacks copper and copper alloys ... attacks aluminum in high concentration |
| Flammpunkt | 32 °F (EPA, 1998)-5 °C (23 °F) - closed cup32 °F(0 °C)(open cup)-1 °C c.c.30 °F |
| Siedepunkt | 171 °F at 760 mmHg (EPA, 1998)77.2 °C77 °C77.3 °C @760 [mm Hg]77.3°C |
| Decomposition | Hazardous decomposition products formed under fire conditions - Carbon oxides, nitrogen oxides (NOx).... When burned may decompose to free cyanide.When heated to decomposition it emits toxic fumes of /nitrogen oxides and cyanides/. |
| Schmelzpunkt | -116 °F (EPA, 1998)-83.51 °C-84 °C-83.48 °C-83°C |
| Dampfdruck | 11.1 kPa |
| Brechungsindex | 1.390-1.392 |
| Aggregatzustand | Liquid |
| Farbe | Clear Colorless |
| Geruch | Mild Peach kernels 21.4 ppm |
| Geruchsschwelle | 21.4 ppm |
| Explosionsgrenze | 3-17% |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH225: Highly Flammable liquid and vapor [Danger Flammable liquids]H301: Toxic if swallowed [Danger Acute toxicity, oral]H311: Toxic in contact with skin [Danger Acute toxicity, dermal]H315: Causes skin irritation [Warning Skin corrosion/irritation]H317: May cause an allergic skin reaction [Warning Sensitization, Skin]H318: Causes serious eye damage [Danger Serious eye damage/eye irritation]H331: Toxic if inhaled [Danger Acute toxicity, inhalation]H335: May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]H350: May cause cancer [Danger Carcinogenicity]H411: Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P203, P210, P233, P240, P241, P242, P243, P261, P262, P264, P264+P265, P270, P271, P272, P273, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P318, P319, P321, P330, P332+P317, P333+P317, P361+P364, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)This chemical does not meet GHS hazard criteria for 0.2% (2 of 1097) of reports. |
|---|---|
| Hazards Identification | Toxic/poison by inhalation (TIH/PIH) |
| Regulatorische Informationen | Chemical: 2-PropenenitrileSpecific Information Requirement: Obligations to provide information apply. These obligations are:1. If the assessment report about the chemical recommends secondary notification of the chemical in particular circumstances and any of the circumstances occur in relation to the introduction (importation or manufacture) of the chemical by a person, then the person introducing this chemical must tell us in writing within 28 calendar days that the circumstances have occurred.2. A person who introduces this chemical must tell us in writing within 28 calendar days if they become aware of any of the following circumstances, namely, that since the assessment under the Industrial Chemicals (Notification and Assessment) Act 1989:a. the function or use of the chemical has changed, or is likely to change, significantlyb. the amount of the chemical being introduced has increased, or is likely to increase, significantly |