HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 70988Erstellt: 27. Oktober 2026
p-Butylbenzaldehyd
butylbenzaldehyde · 4-BUTYLBENZALDEHYDE · Benzaldehyde, 4-butyl- · SKL090 · 4-butyl-benzaldehyd · P-BUTYLBENZALDEHYDE · 4-n-Butylbenzaldehyde · 4-Butylbenzaldehyde,99%
https://huagongshe.com/de/chemical/70988
Identifikatoren & physikalische Daten
| CAS No. | 1200-14-2 |
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| Summenformel | C11H14O |
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| Durchschnittliche Molmasse | 162,23 g/mol |
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| Monoisotopische Masse | 162,10446507 g/mol |
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| SMILES | CCCCc1ccc(C=O)cc1 |
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| InChIKey | ARIREUPIXAKDAY-UHFFFAOYSA-N |
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| PubChem CID | 70988 |
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| ChEMBL | CHEMBL242748 |
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| EC No. | 214-851-2 |
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| DTXSID | DTXSID0061616 |
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| Lokaler Name | p-Butylbenzaldehyd |
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Chemische & physikalische Eigenschaften
| XLogP | 3,2 |
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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 | 4 |
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| Schwere Atome | 12 |
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| Formalladung | 0 |
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| Komplexität | 123 |
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| Schmelzpunkt | -43°C |
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| Siedepunkt | 250-263 °C(lit.) |
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| Dichte | 0.968 g/mL at 25 °C(lit.) |
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| Brechungsindex | n20/D 1.522(lit.) |
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| Flammpunkt | 96-98°C/5mm |
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| Lagerbedingungen | 2-8°C, stored under nitrogen |
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| Aggregatzustand | clear liquid |
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| Farbe | Colorless to Yellow |
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| BRN | 2208267 |
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| InChI | 1S/C11H14O/c1-2-3-4-10-5-7-11(9-12)8-6-10/h5-9H,2-4H2,1H3 |
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| InChIKey | ARIREUPIXAKDAY-UHFFFAOYSA-N |
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| SMILES | CCCCc1ccc(C=O)cc1 |
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| CAS Datenbank | 1200-14-2(CAS DataBase Reference) |
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| EPA chemische Informationen | Benzaldehyde, 4-butyl- (1200-14-2) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+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 | Acute Tox. 4 (100%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| TSCA-Inventar-Status | TSCA listed |
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| Zollcode | 2912290090 |
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| R-Sätze (R) | 22-36/37/38 |
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| Gefahrensymbole | Xn |
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| Sicherheitshinweise (S) | 26-36 |
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| Lagerklasse | 11 - Combustible Solids |
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| Gefahrenklasse | Acute Tox. 4 OralAquatic Chronic 3Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
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