HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 574151Erstellt: 23. Oktober 2026
Methyl 3-thiophenecarboxylate
Methyl thiophene-3-carboxylate · THOO1 · 3-Methoxycarbonylthiophene · Methyl 3-thiophenecarboxylate · Methyl 3-thiophenecarboxylate 97 · Methyl Thiophene-3-carboxylate >Thiophene-3-carboxylic acid methyl ester · 3- thiophene carboxylic acidMethyl ester · METHYL 3-THIOPHENECARBOXYLATE 97 ISO 9001：2015 REACH
https://huagongshe.com/de/chemical/574151
Identifikatoren & physikalische Daten
| CAS No. | 22913-26-4 |
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| Summenformel | C6H6O2S |
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| Durchschnittliche Molmasse | 142,18 g/mol |
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| Monoisotopische Masse | 142,00885043 g/mol |
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| SMILES | COC(=O)c1ccsc1 |
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| InChIKey | ZTRAEMILTFNZSM-UHFFFAOYSA-N |
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| PubChem CID | 574151 |
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| EC No. | 628-219-2 |
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| DTXSID | DTXSID20341583 |
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Chemische & physikalische Eigenschaften
| XLogP | 1,8 |
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| Polarare Oberfläche (TPSA) | 54,5 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 9 |
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| Formalladung | 0 |
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| Komplexität | 114 |
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| Siedepunkt | 98 °C/10 mmHg (lit.) |
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| Dichte | 1.174 g/mL at 25 °C (lit.) |
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| Brechungsindex | n20/D 1.5380(lit.) |
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| Flammpunkt | 172 °F |
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| Lagerbedingungen | Keep in dark place,Sealed in dry,Room Temperature |
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| Aggregatzustand | clear liquid |
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| Farbe | Colorless to Light yellow |
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| InChI | 1S/C6H6O2S/c1-8-6(7)5-2-3-9-4-5/h2-4H,1H3 |
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| InChIKey | ZTRAEMILTFNZSM-UHFFFAOYSA-N |
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| SMILES | COC(=O)c1ccsc1 |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 2 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) | 2 |
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| UN-Transportnummer | NA 1993 / PGIII |
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| Zollcode | 29349990 |
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| R-Sätze (R) | 36/37/38-43 |
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| Gefahrensymbole | Xi |
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| Sicherheitshinweise (S) | 26-36/37 |
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| Lagerklasse | 10 - Combustible liquids |
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| Gefahrenklasse | Eye Irrit. 2Skin Irrit. 2Skin Sens. 1STOT SE 3 |
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