HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 80474Erstellt: 26. Oktober 2026
5-Chlorvaleronitril
5-Chloropentanenitrile · CVN · 5-Chloropentanil · Chlorovaleronitrile · 5-Chlorovaneronitrile · 5-chlorovaIeronitrile · 4-Chlorobutyl Cyanide · 5-CHLOROVALERONITRILE
https://huagongshe.com/de/chemical/80474
Identifikatoren & physikalische Daten
| CAS No. | 6280-87-1 |
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| Summenformel | C5H8ClN |
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| Durchschnittliche Molmasse | 117,58 g/mol |
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| Monoisotopische Masse | 117,03452694 g/mol |
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| SMILES | N#CCCCCCl |
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| InChIKey | JSAWFGSXRPCFSW-UHFFFAOYSA-N |
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| PubChem CID | 80474 |
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| EC No. | 228-481-4 |
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| DTXSID | DTXSID20211898 |
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| Lokaler Name | 5-Chlorvaleronitril |
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Chemische & physikalische Eigenschaften
| XLogP | 1,2 |
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| Polarare Oberfläche (TPSA) | 23,8 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 1 |
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| Frei drehbare Bindungen | 3 |
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| Schwere Atome | 7 |
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| Formalladung | 0 |
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| Komplexität | 71,4 |
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| SpringerMaterials Properties | Nuclear quadrupole resonance spectroscopy |
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| Siedepunkt | 92-93 °C (10 mmHg) |
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| Dichte | 1.045 g/mL at 25 °C (lit.) |
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| Brechungsindex | n20/D 1.446(lit.) |
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| Flammpunkt | 209 °F |
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| Lagerbedingungen | Inert atmosphere,2-8°C |
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| Löslichkeit | Chloroform (Slightly), Ethyl Acetate (Slightly) |
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| Aggregatzustand | Liquid |
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| Farbe | Clear |
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| BRN | 1742079 |
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| InChI | InChI=1S/C5H8ClN/c6-4-2-1-3-5-7/h1-4H2 |
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| InChIKey | JSAWFGSXRPCFSW-UHFFFAOYSA-N |
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| SMILES | C(#N)CCCCCl |
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| CAS Datenbank | 6280-87-1(CAS DataBase Reference) |
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| NIST chemische Informationen | 5-Chlorovaleronitrile(6280-87-1) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH301 (91.7%): Toxic if swallowed [Danger Acute toxicity, oral]P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 48 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Acute Tox. 3 (91.7%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| UN-Transportnummer | UN 3276 6.1/PG 3 |
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| Zollcode | 29269095 |
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| R-Sätze (R) | 23/24/25 |
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| Gefahrensymbole | T,Xi |
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| hazard_note | Toxic |
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| Sicherheitshinweise (S) | 36/37/39-45 |
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| Gefahrenklasse | 6.1Acute Tox. 3 DermalAcute Tox. 3 InhalationAcute Tox. 3 Oral |
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| Verpackungsgruppe | III |
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| Lagerklasse | 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects |
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