HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 36664Erstellt: 27. Oktober 2026
Methyl-4-(chlormethyl)benzoat
Dapoxetine Impurity 104 · METHYL ALPHA-CHLORO-P-TOLUATE · METHYL 4-(CHLOROMETHYL)BENZOATE · METHYL P-(CHLOROMETHYL)BENZOATE · 4-(Methoxycarbonyl)benzyl chloride · Methyl 4-(chloromethyl)benzoate,97% · Methyl 4-(Chloromethyl)benzoate >4-Chloromethylbenzoate methyl ester · Methyl 4-(chloroMethyl)benzoate, 98%+
https://huagongshe.com/de/chemical/36664
Identifikatoren & physikalische Daten
| CAS No. | 34040-64-7 |
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| Summenformel | C9H9ClO2 |
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| Durchschnittliche Molmasse | 184,62 g/mol |
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| Monoisotopische Masse | 184,02910721 g/mol |
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| SMILES | COC(=O)c1ccc(CCl)cc1 |
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| InChIKey | SATDLKYRVXFXRE-UHFFFAOYSA-N |
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| PubChem CID | 36664 |
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| EC No. | 251-806-6 |
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| DTXSID | DTXSID30187651 |
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| Lokaler Name | Methyl-4-(chlormethyl)benzoat |
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Chemische & physikalische Eigenschaften
| XLogP | 2,7 |
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| Polarare Oberfläche (TPSA) | 26,3 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 3 |
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| Schwere Atome | 12 |
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| Formalladung | 0 |
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| Komplexität | 151 |
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| SpringerMaterials Properties | Chemical shift |
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| Schmelzpunkt | 39 °C |
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| Siedepunkt | 160 °C |
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| Dichte | 1.190±0.06 g/cm3(Predicted) |
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| Brechungsindex | 1.52 |
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| Flammpunkt | 160-165°C/30mm |
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| Lagerbedingungen | Inert atmosphere,2-8°C |
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| Löslichkeit | soluble in Methanol |
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| Aggregatzustand | Low Melting Solid |
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| Farbe | White |
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| InChI | InChI=1S/C9H9ClO2/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-5H,6H2,1H3 |
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| InChIKey | SATDLKYRVXFXRE-UHFFFAOYSA-N |
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| SMILES | C(OC)(=O)C1=CC=C(CCl)C=C1 |
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| CAS Datenbank | 34040-64-7(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (14.3%): Harmful if swallowed [Warning Acute toxicity, oral]P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 7 reports by companies from 4 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. 4 (14.3%) |
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| UN-Transportnummer | 3261 |
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| Zollcode | 29163990 |
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| R-Sätze (R) | 34-36/37/38 |
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| Gefahrensymbole | C |
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| Sicherheitshinweise (S) | 26-36/37/39-45 |
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| Gefahrenklasse | 8 |
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| Verpackungsgruppe | III |
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