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HCID 97854Erstellt: 27. Oktober 2026
3,5-Dimethylcyclohex-3-en-1-carbaldehyd
CYCLAL C · 3,5-ivy carbaldehyde · TRIVERTAL · NSC 48084 · Einecs 268-263-6 · Agrumen aldehyde · 5-Formyl-1,3-dimethylcyclohex-1-ene · 1-Formyl-3,5-dimethyl-3-cyclohexene
https://huagongshe.com/de/chemical/97854
Identifikatoren & physikalische Daten
| CAS No. | 68039-48-5 |
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| Summenformel | C9H14O |
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| Durchschnittliche Molmasse | 138,21 g/mol |
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| Monoisotopische Masse | 138,10446507 g/mol |
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| SMILES | CC1=CC(C)CC(C=O)C1 |
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| InChIKey | ZHDQGHCZWWDMRS-UHFFFAOYSA-N |
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| PubChem CID | 97854 |
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| EC No. | 268-263-6 |
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| DTXSID | DTXSID4052390 |
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| Lokaler Name | 3,5-Dimethylcyclohex-3-en-1-carbaldehyd |
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Chemische & physikalische Eigenschaften
| XLogP | 1,4 |
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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 | 158 |
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| Duftstoffe | Fragrance Ingredient (3,5-Dimethylcyclohex-3-ene-1-carbaldehyde) -> IFRA transparency List |
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| Siedepunkt | 196 °C(lit.) |
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| Dichte | 0.936 g/mL at 25 °C(lit.) |
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| Brechungsindex | n20/D 1.473(lit.) |
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| Flammpunkt | 151 °F |
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| Geruch | at 100.00 %. fresh green herbal citric soapy clean |
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| Geruchsart | green |
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| Kosmetik-Inhaltsstoffe Funktionen | PERFUMING |
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| LogP (Verteilungskoeffizient) | 2.67 |
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| EPA chemische Informationen | 3-Cyclohexene-1-carboxaldehyde, 3,5-dimethyl- (68039-48-5) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH317: May cause an allergic skin reaction [Warning Sensitization, Skin]P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)H312 (11.8%): Harmful in contact with skin [Warning Acute toxicity, dermal]P261, P264, P264+P265, P272, P273, P280, P302+P352, P305+P351+P338, P317, P321, P332+P317, P333+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement) |
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| Regulatorische Informationen | Chemical: 3-Cyclohexene-1-carboxaldehyde, 3,5-dimethyl-3-Cyclohexene-1-carboxaldehyde, 3,5-dimethyl-: Does not have an individual approval but may be used under an appropriate group standard |
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| Weitere Sicherheitsinformationen | IMAP assessments - 3-Cyclohexene-1-carboxaldehyde, 3,5-dimethyl-: Environment tier I assessment |
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| Hazard Classes and Categories | Acute Tox. 4 (11.8%)Skin Sens. 1B |
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| Wassergefährdungsklasse (WGK) | - |
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| TSCA-Inventar-Status | TSCA listed |
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