HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 22505713Erstellt: 26. Oktober 2026
1-Bromo-2-methoxy-3-nitrobenzene
2-Bromo-6-nitroanisole · 3-Bromo-2-methoxynitrobenzene · 1-bromo-2-methoxy-3-Nitroenzene · 1-Bromo-2-methoxy-3-nitro-benzene · 2-bromo-6-nitrophenyl methyl ether · Benzene,1-bromo-2-methoxy-3-nitro- · 3-BroMo-2-Methoxynitrobenzene[2-BroMo-6-nitroanisole] · 2-BROMO-6-NITRO ANISOLE / 1-Bromo-2-methoxy-3-nitrobenzene
https://huagongshe.com/de/chemical/22505713
Identifikatoren & physikalische Daten
| CAS No. | 98775-19-0 |
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| Summenformel | C7H6BrNO3 |
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| Durchschnittliche Molmasse | 232,03 g/mol |
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| Monoisotopische Masse | 230,95310515 g/mol |
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| SMILES | COc1c(Br)cccc1[N+](=O)[O-] |
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| InChIKey | YAYBLVOBUIXMQY-UHFFFAOYSA-N |
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| PubChem CID | 22505713 |
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| EC No. | 807-179-1 |
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| DTXSID | DTXSID00913085 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,4 |
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| Polarare Oberfläche (TPSA) | 55,1 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 12 |
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| Formalladung | 0 |
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| Komplexität | 171 |
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| Siedepunkt | 296.4±20.0 °C(Predicted) |
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| Dichte | 1.640±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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| Aggregatzustand | solid |
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| Farbe | Off white to faint yellow |
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| InChI | InChI=1S/C7H6BrNO3/c1-12-7-5(8)3-2-4-6(7)9(10)11/h2-4H,1H3 |
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| InChIKey | YAYBLVOBUIXMQY-UHFFFAOYSA-N |
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| SMILES | C1(Br)=CC=CC([N+]([O-])=O)=C1OC |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, 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 | Acute Tox. 4 (100%) |
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| Zollcode | 2909309090 |
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