HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 5166798Erstellt: 23. Oktober 2026
3-Iodo-4-methylbenzyl alcohol
Benzenemethanol, 3-iodo-4-methyl- · 3-IODO-4-METHYLBENZYL ALCOHOL 97 · (3-Iodo-4-methyl-phenyl)-methanol · 3-Iodo-4-methylbenzyl alcohol
https://huagongshe.com/de/chemical/5166798
Identifikatoren & physikalische Daten
| CAS No. | 165803-89-4 |
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| Summenformel | C8H9IO |
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| Durchschnittliche Molmasse | 248,06 g/mol |
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| Monoisotopische Masse | 247,96981291 g/mol |
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| SMILES | Cc1ccc(CO)cc1I |
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| InChIKey | KOJVNDPZLOBKMK-UHFFFAOYSA-N |
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| PubChem CID | 5166798 |
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| EC No. | 625-125-3 |
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| DTXSID | DTXSID50409084 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,1 |
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| Polarare Oberfläche (TPSA) | 20,2 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 1 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 10 |
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| Formalladung | 0 |
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| Komplexität | 105 |
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| Schmelzpunkt | 75-79 °C(lit.) |
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| Siedepunkt | 303.8±30.0 °C(Predicted) |
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| Dichte | 1.751±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | 2-8°C, protect from light |
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| Aggregatzustand | solid |
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| pKa (Säurekonstante) | 14.10±0.10(Predicted) |
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| Farbe | Yellow |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): 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 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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| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| Zollcode | 2906290090 |
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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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