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HCID 853Erstellt: 4. November 2026
O-(4-Hydroxy-3,5-diiodphenyl)-3,5-diiod-DL-tyrosin
hyroxine · DL-THYROXINE · DL-ThyroxinefreeAcid · Thyroxine, DL- (8CI) · tetraiodothyronine，T4 · 3,3',5,5'-TETRAIODO-DL-THY · DL-3,3',5,5'-TETRAIODOTHYRONINE · 3,3',5,5'-TETRAIODO-DL-THYRONINE
https://huagongshe.com/de/chemical/853
Identifikatoren & physikalische Daten
| CAS No. | 300-30-1 |
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| Summenformel | C15H11I4NO4 |
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| Durchschnittliche Molmasse | 776,87 g/mol |
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| Monoisotopische Masse | 776,6867 g/mol |
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| SMILES | NC(Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(=O)O |
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| InChIKey | XUIIKFGFIJCVMT-UHFFFAOYSA-N |
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| PubChem CID | 853 |
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| ChEMBL | CHEMBL42115 |
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| ChEBI | CHEBI:30660 |
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| EC No. | 206-088-9 |
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| DTXSID | DTXSID0023662 |
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| Lokaler Name | O-(4-Hydroxy-3,5-diiodphenyl)-3,5-diiod-DL-tyrosin |
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Chemische & physikalische Eigenschaften
| XLogP | 2,4 |
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| Polarare Oberfläche (TPSA) | 92,8 |
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| H-Brücken-Donoren | 3 |
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| H-Brücken-Akzeptoren | 5 |
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| Frei drehbare Bindungen | 5 |
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| Schwere Atome | 24 |
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| Formalladung | 0 |
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| Komplexität | 420 |
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| Schmelzpunkt | 211 °C (decomp) |
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| Siedepunkt | 576.3±50.0 °C(Predicted) |
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| Dichte | 2.635±0.06 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 2.12±0.30(Predicted) |
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| Merck | 9415 |
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| CAS Datenbank | 300-30-1(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH372 (100%): Causes damage to organs through prolonged or repeated exposure [Danger Specific target organ toxicity, repeated exposure]P260, P264, P270, P319, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | STOT RE 1 (100%) |
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| Zollcode | 2922500090 |
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