HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 10901Erstellt: 27. Oktober 2026
Aminoacetonitril
2-Aminoacetonitrile · Glycinonitrile · SKL069 · H2NCH2CN · Glycinenitrile · Cyanomethylamine · Aminocyanomethane · amino-acetonitril
https://huagongshe.com/de/chemical/10901
Identifikatoren & physikalische Daten
| CAS No. | 540-61-4 |
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| Summenformel | C2H4N2 |
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| Durchschnittliche Molmasse | 56,07 g/mol |
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| Monoisotopische Masse | 56,03744813 g/mol |
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| SMILES | N#CCN |
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| InChIKey | DFNYGALUNNFWKJ-UHFFFAOYSA-N |
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| PubChem CID | 10901 |
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| ChEMBL | CHEMBL1193997 |
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| EC No. | 208-751-8 |
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| DTXSID | DTXSID90202314 |
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| Lokaler Name | Aminoacetonitril |
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Chemische & physikalische Eigenschaften
| XLogP | -1,4 |
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| Polarare Oberfläche (TPSA) | 49,8 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 0 |
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| Schwere Atome | 4 |
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| Formalladung | 0 |
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| Komplexität | 39,2 |
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| Stoffklassen | Nitrogen Compounds -> Nitriles |
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| SpringerMaterials Properties | Schoenflies notation |
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| LogP (Verteilungskoeffizient) | -1.37 |
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| Dampfdruck | 7.94 [mmHg] |
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| Physical Description | Oily liquid[Merck Index] |
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| Schmelzpunkt | 101 °C |
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| Siedepunkt | bp15 58° (partial decompn) |
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| Dichte | 0.7789 (rough estimate) |
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| Brechungsindex | 1.4180 (estimate) |
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| Lagerbedingungen | -20°C |
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| Aggregatzustand | liquid |
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| pKa (Säurekonstante) | 5.34(at 25℃) |
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| InChI | InChI=1S/C2H4N2/c3-1-2-4/h1,3H2 |
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| InChIKey | DFNYGALUNNFWKJ-UHFFFAOYSA-N |
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| SMILES | C(#N)CN |
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| CAS Datenbank | 540-61-4 |
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| NIST chemische Informationen | NCCH2NH2(540-61-4) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P203, P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P318, P321, P330, P362+P364, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Regulatorische Informationen | Chemical: Acetonitrile, amino- |
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| Gefahrenübersicht | May cause irritation[MSDSonline] See NITRILES. |
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| Hazard Classes and Categories | Acute Tox. 4 (100%) |
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| Unerwünschte Wirkungen | Other Poison - Chemical Asphyxiant |
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| Wassergefährdungsklasse (WGK) | 3 |
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| UN-Transportnummer | NA 1993 / PGIII |
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| RTECS-Nr. | AL7750000 |
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| R-Sätze (R) | 20/21/22-40 |
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| Gefahrensymbole | Xn |
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| Sicherheitshinweise (S) | 23-36 |
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| Lagerklasse | 10 - Combustible liquids |
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| Gefahrenklasse | Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralCarc. 2 |
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