HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 20042Erstellt: 27. Oktober 2026
4-tert-Butyl-2,6-dinitrophenol
AKOS BC-0676 · LABOTEST-BB LT00160050 · (TERT)BUTYLDINITROPHENOL · 2,6-DINITRO-4-TERT-BUTYLPHENOL · 4-TERT-BUTYL-2,6-DINITROPHENOL · 4-terti-Butyl-2,6-dinitrophenol · 2,6-Dinitro-p-(tert-butyl)phenol · 4-TERT-BUTYL-2,6-DINITROPHENOL 97%
https://huagongshe.com/de/chemical/20042
Identifikatoren & physikalische Daten
| CAS No. | 4097-49-8 |
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| Summenformel | C10H12N2O5 |
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| Durchschnittliche Molmasse | 240,21 g/mol |
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| Monoisotopische Masse | 240,07462148 g/mol |
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| SMILES | CC(C)(C)c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1 |
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| InChIKey | NJBDTWSOYUZQPM-UHFFFAOYSA-N |
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| PubChem CID | 20042 |
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| EC No. | 223-856-9 |
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| DTXSID | DTXSID50193971 |
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| Lokaler Name | 4-tert-Butyl-2,6-dinitrophenol |
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Chemische & physikalische Eigenschaften
| XLogP | 3,4 |
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| Polarare Oberfläche (TPSA) | 112 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 5 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 17 |
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| Formalladung | 0 |
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| Komplexität | 290 |
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| Endocrine Disruptors | Potential endocrine disrupting compound |
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| Schmelzpunkt | 93-96°C |
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| Aggregatzustand | powder to crystal |
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| Farbe | Light yellow to Yellow to Orange |
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| BRN | 1986466 |
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| CAS Datenbank | 4097-49-8(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH301 (33.3%): Toxic if swallowed [Danger Acute toxicity, oral]P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 6 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 | Acute Tox. 3 (33.3%) |
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| UN-Transportnummer | 2811 |
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| Zollcode | 29089990 |
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| R-Sätze (R) | 20/21/22-36/37/38 |
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| Sicherheitshinweise (S) | 26-36 |
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| Gefahrenklasse | 6.1 |
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| Verpackungsgruppe | III |
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