HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 10972Erstellt: 26. Oktober 2026
N-Acetylglycin
AC-GLY-OH · ACETURIC ACID · 2-Acetamidoacetic acid · N-Ac-Gly-OH · N-Aceylglycine · ACETAMIDOACETIC ACID · AC GLY · NSC 7605
https://huagongshe.com/de/chemical/10972
Identifikatoren & physikalische Daten
| CAS No. | 543-24-8 |
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| Summenformel | C4H7NO3 |
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| Durchschnittliche Molmasse | 117,1 g/mol |
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| Monoisotopische Masse | 117,04259308 g/mol |
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| SMILES | CC(=O)NCC(=O)O |
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| InChIKey | OKJIRPAQVSHGFK-UHFFFAOYSA-N |
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| PubChem CID | 10972 |
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| ChEMBL | CHEMBL289004 |
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| ChEBI | CHEBI:40410 |
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| EC No. | 208-839-6 |
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| DTXSID | DTXSID2043793 |
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| Lokaler Name | N-Acetylglycin |
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Chemische & physikalische Eigenschaften
| XLogP | -1,2 |
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| Polarare Oberfläche (TPSA) | 66,4 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 8 |
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| Formalladung | 0 |
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| Komplexität | 110 |
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| Stoffklassen | Nitrogen Compounds -> Amino Carboxylic Acids |
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| Arzneimittel | Pharmaceuticals -> Listed in ZINC15 |
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| SpringerMaterials Properties | Boiling point |
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| Löslichkeit | 26.3 mg/mL at 15 °C26.3g/l2.7 g/100 mL (15 ºC) |
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| Schmelzpunkt | 207 - 209 °C207-209 °C (lit.) |
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| Physical Description | Solid[Merck Index] White powder[Alfa Aesar MSDS] |
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| Collision Cross Section | 133 Ų [M+Na]+ [CCS Type: DTMethod: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]132.3 Ų [M+Na]+ |
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| Siedepunkt | 218.88°C (rough estimate) |
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| Dichte | 1.3886 (rough estimate) |
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| Brechungsindex | 1.4540 (estimate) |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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| pKa (Säurekonstante) | 3.669(at 25℃) |
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| Aggregatzustand | Crystalline Powder |
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| Farbe | White |
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| Merck | 14,80 |
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| BRN | 774114 |
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| Hauptanwendungen | clinical testing |
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| InChI | 1S/C4H7NO3/c1-3(6)5-2-4(7)8/h2H2,1H3,(H,5,6)(H,7,8) |
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| InChIKey | OKJIRPAQVSHGFK-UHFFFAOYSA-N |
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| SMILES | CC(=O)NCC(O)=O |
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| CAS Datenbank | 543-24-8(CAS DataBase Reference) |
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| NIST chemische Informationen | Glycine, N-acetyl-(543-24-8) |
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| EPA chemische Informationen | Glycine, N-acetyl- (543-24-8) |
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Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 75% (3 of 4) of all reports.WarningH315 (25%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 4 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Regulatorische Informationen | Chemical: Glycine, N-acetyl-Glycine, N-acetyl-: Does not have an individual approval but may be used under an appropriate group standard |
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| Weitere Sicherheitsinformationen | Evaluation - Chemicals that are unlikely to require further regulation to manage risks to environment |
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| Gefahrenübersicht | May cause irritation[Alfa Aesar MSDS] |
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| Hazard Classes and Categories | Skin Irrit. 2 (25%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| TSCA-Inventar-Status | TSCA listed |
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| Zollcode | 29241900 |
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| R-Sätze (R) | 36/37/38 |
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| Gefahrensymbole | Xi |
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| Sicherheitshinweise (S) | 22-24/25-36-26 |
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| Gefahrenklasse | IRRITANT |
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| Lagerklasse | 11 - Combustible Solids |
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