HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
3-Chlor-2-(chlormethyl)propen
3-Chloro-2-(chloromethyl)prop-1-ene · METHALLYL DICHLORIDE · 3-Chloro-2-(chloromethyl)propene · 2-Chloromethyl-3-chloropropene · 3-CHLORO-2-CHLOROMETHYL-1-PROPENE · 1-Chloro-2-(chloromethyl)-2-propene · 2-(CHLOROMETHYL)-3-(TRICHLOROSILYL)PROPENE · 1,1-BIS(CHLOROMETHYL)ETHYLENE
Identifikatoren & physikalische Daten
| CAS No. | 1871-57-4 |
|---|---|
| Summenformel | C4H6Cl2 |
| Durchschnittliche Molmasse | 124,99 g/mol |
| Monoisotopische Masse | 123,98465555 g/mol |
| SMILES | C=C(CCl)CCl |
| InChIKey | XJFZOSUFGSANIF-UHFFFAOYSA-N |
| PubChem CID | 15859 |
| ChEMBL | CHEMBL160833 |
| EC No. | 217-489-3 |
| DTXSID | DTXSID3022166 |
| Lokaler Name | 3-Chlor-2-(chlormethyl)propen |
Chemische & physikalische Eigenschaften
| XLogP | 2,1 |
|---|---|
| Polarare Oberfläche (TPSA) | 0 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 0 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 6 |
| Formalladung | 0 |
| Komplexität | 43,5 |
| SpringerMaterials Properties | Schoenflies notation |
| Schmelzpunkt | -14 °C (lit.) |
| Siedepunkt | 138 °C (lit.) |
| Dichte | 1.08 g/mL at 25 °C (lit.) |
| Dampfdichte | 3.12 (vs air) |
| Brechungsindex | n20/D 1.484(lit.) |
| Flammpunkt | 98 °F |
| Lagerbedingungen | 2-8°C |
| Löslichkeit | Chloroform, Ethyl Acetate (Slightly) |
| Aggregatzustand | Liquid |
| Farbe | Clear colorless to yellow |
| Wichte | 1.08 |
| Explosionsgrenze | 8.1% |
| BRN | 1560178 |
| InChI | 1S/C4H6Cl2/c1-4(2-5)3-6/h1-3H2 |
| InChIKey | XJFZOSUFGSANIF-UHFFFAOYSA-N |
| SMILES | ClCC(=C)CCl |
| CAS Datenbank | 1871-57-4(CAS DataBase Reference) |
| EPA chemische Informationen | 1-Propene, 3-chloro-2-(chloromethyl)- (1871-57-4) |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH226 (100%): Flammable liquid and vapor [Warning Flammable liquids]P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 44 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Flam. Liq. 3 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| UN-Transportnummer | UN 2987 8/PG 2 |
| Zollcode | 29032990 |
| RTECS-Nr. | UC7400000 |
| R-Sätze (R) | 14-34-36/37/38-25-10-36-50-23/25 |
| Gefahrensymbole | T,Xi,F,N |
| Sicherheitshinweise (S) | 26-27-36/37/39-45-36-16-61-37/39 |
| Gefahrenklasse | 6.1(a)Acute Tox. 2 InhalationAcute Tox. 3 OralEye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3 |
| Verpackungsgruppe | I |
| Lagerklasse | 3 - Flammable liquids |
| Selbstentzündungstemperatur | 896 °F |
Anwendungen & Verwendung
Verwenden
3-Chloro-2-chloromethyl-1-propene can be used in the synthesis of 2,11-bis(methylidene)spermine, an inhibitor of spermine oxidase and branched side chains of conjugated polymers. It can also be used in the intermolecular [2+2] photocycloaddition during the total synthesis of ()-grandisol.