HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
2-Chlorethylisocyanat
CIC · Protein capicua homolog · ISOCYANIC ACID 2-CHLOROETHYL ESTER · 2-CHLOROETHYL ISOCYANATE, LOW HCL, 97% · ANTI-CIC (N-TERM) antibody produced in rabbit · nsc87418 · KIAA0306 · 2-Chloroethyl isocya
Identifikatoren & physikalische Daten
| CAS No. | 1943-83-5 |
|---|---|
| Summenformel | C3H4ClNO |
| Durchschnittliche Molmasse | 105,52 g/mol |
| Monoisotopische Masse | 104,99814143 g/mol |
| SMILES | O=C=NCCCl |
| InChIKey | BCMYXYHEMGPZJN-UHFFFAOYSA-N |
| PubChem CID | 16035 |
| EC No. | 217-734-4 |
| DTXSID | DTXSID2062080 |
| Lokaler Name | 2-Chlorethylisocyanat |
Chemische & physikalische Eigenschaften
| XLogP | 1,6 |
|---|---|
| Polarare Oberfläche (TPSA) | 29,4 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 6 |
| Formalladung | 0 |
| Komplexität | 67,2 |
| SpringerMaterials Properties | Dielectric constant |
| Schmelzpunkt | 144-145 °C |
| Siedepunkt | 141-142 °C(lit.) |
| Dichte | 1.237 g/mL at 25 °C(lit.) |
| Brechungsindex | n20/D 1.447(lit.) |
| Flammpunkt | 135 °F |
| Lagerbedingungen | 2-8°C |
| Aggregatzustand | Liquid |
| Farbe | Clear colorless to slightly yellow |
| Biologische Quelle | rabbit |
| Löslichkeit | reacts |
| BRN | 1071429 |
| Stabilität | Stable, but moisture sensitive. Combustible. Incompatible with water, moisture, strong oxidizing agents, strong bases, acids, alcohols, amines. |
| InChI | 1S/C3H4ClNO/c4-1-2-5-3-6/h1-2H2 |
| InChIKey | BCMYXYHEMGPZJN-UHFFFAOYSA-N |
| SMILES | ClCCN=C=O |
| CAS Datenbank | 1943-83-5(CAS DataBase Reference) |
| EPA chemische Informationen | Ethane, 1-chloro-2-isocyanato- (1943-83-5) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH226 (100%): Flammable liquid and vapor [Warning Flammable liquids]P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P284, P301+P316, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P342+P316, P362+P364, P370+P378, P403, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 53 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Flam. Liq. 3 (100%) |
| F | 10-19 |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | UN 1993 3/PG 3 |
| Zollcode | 29291090 |
| RTECS-Nr. | NQ8450000 |
| R-Sätze (R) | 20/21/22-36/37/38-42-34-23/24/25 |
| Gefahrensymbole | Xn,T,C |
| hazard_note | Toxic/Corrosive/Lachrymatory/Sensitizer |
| Sicherheitshinweise (S) | 26-36-45-38-36/37/39-28A-23-7/9 |
| Gefahrenklasse | 6.1Acute Tox. 3 InhalationAcute Tox. 3 OralEye Irrit. 2Flam. Liq. 3Resp. Sens. 1Skin Irrit. 2Skin Sens. 1STOT SE 3 |
| Verpackungsgruppe | II |
| Lagerklasse | 3 - Flammable liquids |
Anwendungen & Verwendung
Verwenden
2-Chloroethyl isocyanate may be used in the synthesis of:8-carbamoyl-3-(2-chloroethyl)imidazo[5,1-d]-l,2,3,5-tetrazin-4(3H)-one1-(2-chloroethyl)-3-(2-hydroxyethyl) urea3-substituted 1-(2-chloroethyl)-3-β-glycosylureas1-(2-chloroethyl)-3-cyclohexyl-1-nitrosourea (CCNU)(2-chloroethyl)-4-acetoxybenzyl ester