HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 98103Erstellt: 24. Oktober 2026
Ethyl-3-aminobutyrat
Ethyl 3-aMinobutanoate · NSC 77084 · RARECHEM AK ET C012 · ETHYL 3-AMINOBUTYRATE · Ethyl beta-aminobutyrate · 3-Aminobutyric acid ethyl ester · 3-Aminobutanoic acid ethyl ester · ETHYL 3-AMINOBUTYRATE, TECH., 90%
https://huagongshe.com/de/chemical/98103
Identifikatoren & physikalische Daten
| CAS No. | 5303-65-1 |
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| Summenformel | C6H13NO2 |
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| Durchschnittliche Molmasse | 131,17 g/mol |
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| Monoisotopische Masse | 131,09462866 g/mol |
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| SMILES | CCOC(=O)CC(C)N |
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| InChIKey | HHIOOBJZIASBFF-UHFFFAOYSA-N |
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| PubChem CID | 98103 |
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| EC No. | 226-153-5 |
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| DTXSID | DTXSID401314973 |
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| Lokaler Name | Ethyl-3-aminobutyrat |
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Chemische & physikalische Eigenschaften
| XLogP | -0,1 |
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| Polarare Oberfläche (TPSA) | 52,3 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 4 |
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| Schwere Atome | 9 |
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| Formalladung | 0 |
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| Komplexität | 93,1 |
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| Siedepunkt | 60-61 °C/13 mmHg (lit.) |
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| Dichte | 0.894 g/mL at 25 °C (lit.) |
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| Brechungsindex | n20/D 1.4241(lit.) |
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| Flammpunkt | 108 °F |
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| Lagerbedingungen | -20°C |
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| Löslichkeit | Chloroform (Slightly), Methanol (Sparingly) |
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| Aggregatzustand | Oil |
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| pKa (Säurekonstante) | 8.84±0.10(Predicted) |
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| Farbe | Colourless |
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| InChI | InChI=1S/C6H13NO2/c1-3-9-6(8)4-5(2)7/h5H,3-4,7H2,1-2H3 |
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| InChIKey | HHIOOBJZIASBFF-UHFFFAOYSA-N |
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| SMILES | C(OCC)(=O)CC(N)C |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH226 (100%): Flammable liquid and vapor [Warning Flammable liquids]P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 41 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Flam. Liq. 3 (100%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| UN-Transportnummer | UN 3272 3/PG 3 |
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| Zollcode | 2922498590 |
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| R-Sätze (R) | 10-36/37/38 |
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| Gefahrensymbole | Xi |
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| Sicherheitshinweise (S) | 16-26-36/37/39 |
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| Gefahrenklasse | 3.2Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3 |
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| Verpackungsgruppe | III |
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| Lagerklasse | 3 - Flammable liquids |
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