Identifikatoren & physikalische Daten
| CAS No. | 31155-09-6 |
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| Summenformel | C7H4Cl2O |
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| Durchschnittliche Molmasse | 175,01 g/mol |
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| Monoisotopische Masse | 173,96392011 g/mol |
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| SMILES | O=Cc1cccc(Cl)c1Cl |
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| InChIKey | LLMLNAVBOAMOEE-UHFFFAOYSA-N |
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| PubChem CID | 35745 |
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| ChEMBL | CHEMBL4645306 |
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| EC No. | 228-711-3 |
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| DTXSID | DTXSID7064239 |
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| Lokaler Name | Dichlorbenzaldehyd |
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Chemische & physikalische Eigenschaften
| XLogP | 3 |
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| Polarare Oberfläche (TPSA) | 17,1 |
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| H-Brücken-Donoren | 0 |
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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 | 127 |
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| EPA chemische Informationen | Benzaldehyde, dichloro- (31155-09-6) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH314 (53%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]P260, P261, P264, P271, P273, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P332+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 100 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Regulatorische Informationen | Chemical: Benzaldehyde, 2,3-dichloro-Status: Active Update: 20-01-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/180402,3-Dichlorobenzaldehyde: Does not have an individual approval but may be used under an appropriate group standard |
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| Hazard Classes and Categories | Skin Corr. 1C (53%) |
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| TSCA-Inventar-Status | TSCA listed |
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