HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 99501Erstellt: 4. November 2026
3-Acetamido-5-amino-4-hydroxybenzolsulfonsure
6-ACLAP · (AAPS) (ACLAP) · 6 Acetyl amino O.A.P.S.A. · 3-(ACETYLAMINO)-5-AMINO-4-HYDROXYBENZEN& · 6-Acylamino-2-aminophenol-4-sulfonicacid · 6-ACETYAMINO-2-AMINOPHENOL-4-SULFONICACID · 6-ACETAMIDO-2-AMINOPHENOL-4-SULFONIC ACID · 6-ACETYLAMINO-2AMINOPHENOL-4-SULFONIC ACID
https://huagongshe.com/de/chemical/99501
Identifikatoren & physikalische Daten
| CAS No. | 40306-75-0 |
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| Summenformel | C8H10N2O5S |
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| Durchschnittliche Molmasse | 246,24 g/mol |
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| Monoisotopische Masse | 246,0310426 g/mol |
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| SMILES | CC(=O)Nc1cc(S(=O)(=O)O)cc(N)c1O |
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| InChIKey | SFUJTLIHMWZDTL-UHFFFAOYSA-N |
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| PubChem CID | 99501 |
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| EC No. | 254-879-2 |
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| DTXSID | DTXSID90885424 |
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| Lokaler Name | 3-Acetamido-5-amino-4-hydroxybenzolsulfonsure |
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Chemische & physikalische Eigenschaften
| XLogP | -1,2 |
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| Polarare Oberfläche (TPSA) | 138 |
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| H-Brücken-Donoren | 4 |
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| H-Brücken-Akzeptoren | 6 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 16 |
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| Formalladung | 0 |
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| Komplexität | 363 |
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| Schmelzpunkt | >300 °C(lit.) |
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| Siedepunkt | 411.6℃[at 101 325 Pa] |
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| Dichte | 1.686±0.06 g/cm3(Predicted) |
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| Dampfdruck | 0Pa at 25℃ |
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| Löslichkeit | 666.667mg/L in organic solvents at 20 ℃1.3-2g/L at 20-30℃ |
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| pKa (Säurekonstante) | -1.65±0.50(Predicted) |
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| LogP (Verteilungskoeffizient) | -0.301 at 30℃ |
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| CAS Datenbank | 40306-75-0(CAS DataBase Reference) |
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| EPA chemische Informationen | Benzenesulfonic acid, 3-(acetylamino)-5-amino-4-hydroxy- (40306-75-0) |
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Sicherheit & Vorschriften
| GHS-Einstufung | This chemical does not meet GHS hazard criteria for 18.4% (9 of 49) of reports.WarningH315 (81.6%): 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 49 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Regulatorische Informationen | REACH registered substance: 3-acetamido-5-amino-4-hydroxybenzenesulphonic acid (EC: 254-879-2) |
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| Hazard Classes and Categories | Skin Irrit. 2 (81.6%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| TSCA-Inventar-Status | TSCA listed |
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| R-Sätze (R) | 36/37/38 |
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| Gefahrensymbole | Xi |
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| Sicherheitshinweise (S) | 26-36 |
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