HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 67285Erstellt: 27. Oktober 2026
6-(Isopropyl)chinolin
ISOPROPYL QUINOLINE · 6-Isopropylquinoline · 6-propan-2-ylquinoline · 6-Isopropylquinoline>6-ISOPROPYLQUINOLINE 97+% · 6-(1-methylethyl)-quinolin · 6-(1-methylethyl)-Quinoline · Quinoline, 6-(1-methylethyl)- · 6-Isopropylquinoline, ≥ 97.0%
https://huagongshe.com/de/chemical/67285
Identifikatoren & physikalische Daten
| CAS No. | 135-79-5 |
|---|
| Summenformel | C12H13N |
|---|
| Durchschnittliche Molmasse | 171,24 g/mol |
|---|
| Monoisotopische Masse | 171,10479942 g/mol |
|---|
| SMILES | CC(C)c1ccc2ncccc2c1 |
|---|
| InChIKey | NKCQEIXYLHACJC-UHFFFAOYSA-N |
|---|
| PubChem CID | 67285 |
|---|
| ChEMBL | CHEMBL3183913 |
|---|
| EC No. | 205-220-2 |
|---|
| DTXSID | DTXSID9047465 |
|---|
| Lokaler Name | 6-(Isopropyl)chinolin |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 3,3 |
|---|
| Polarare Oberfläche (TPSA) | 12,9 |
|---|
| H-Brücken-Donoren | 0 |
|---|
| H-Brücken-Akzeptoren | 1 |
|---|
| Frei drehbare Bindungen | 1 |
|---|
| Schwere Atome | 13 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 165 |
|---|
| Stoffklassen | Nitrogen Compounds -> Quinolines |
|---|
| Duftstoffe | Fragrance Ingredient (6-Isopropylquinoline) -> IFRA transparency List |
|---|
| Dampfdruck | 0.01 [mmHg] |
|---|
| Physical Description | Colorless to yellow liquid with an earthy, woody odor[Bedoukian Research MSDS] |
|---|
| Collision Cross Section | 138.0 Ų [M+H]+ [CCS Type: DTBuffer gas: N2Ionization: APCI+Dataset: TOXCASTSource Identifier: DTXSID9047465] |
|---|
| Siedepunkt | 143°C 12mm |
|---|
| Dichte | 1,02 g/cm3 |
|---|
| Brechungsindex | 1.5880-1.5920 |
|---|
| Lagerbedingungen | 2-8°C |
|---|
| Aggregatzustand | clear liquid |
|---|
| pKa (Säurekonstante) | 5.16±0.10(Predicted) |
|---|
| Farbe | Colorless to Light yellow to Light orange |
|---|
| Wichte | 1.02 |
|---|
| Geruch | at 1.00 % in dipropylene glycol. weedy green metallic earthy leafy cortex phenolic nutty |
|---|
| Geruchsart | green |
|---|
| Kosmetik-Inhaltsstoffe Funktionen | PERFUMING |
|---|
| LogP (Verteilungskoeffizient) | 3.537 (est) |
|---|
| CAS Datenbank | 135-79-5(CAS DataBase Reference) |
|---|
| EPA chemische Informationen | Quinoline, 6-(1-methylethyl)- (135-79-5) |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (99.7%): Harmful if swallowed [Warning Acute toxicity, oral]P262, P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P316, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 316 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|
| Regulatorische Informationen | Chemical: Quinoline, 6-(1-methylethyl)-Quinoline, 6-(1-methylethyl)-: Does not have an individual approval but may be used under an appropriate group standard |
|---|
| Weitere Sicherheitsinformationen | IMAP assessments - Quinoline, 6-(1-methylethyl)-: Environment tier I assessment |
|---|
| Gefahrenübersicht | An irritantNo skin sensitization observed in humans at 2% in petrolatumHarmful by ingestionToxic by skin contact[Bedoukian Research MSDS] See Quinoline. |
|---|
| Hazard Classes and Categories | Acute Tox. 4 (99.7%) |
|---|
| TSCA-Inventar-Status | TSCA listed |
|---|
| Zollcode | 2933499090 |
|---|
| R-Sätze (R) | 20/21/22 |
|---|
| Sicherheitshinweise (S) | 23-36/37/39 |
|---|
