6-Ethoxy-1,2,3,4-tetrahydro-2,2,4-trimethylchinolin

Einecs 240-546-9 · Ethoxyquin-3,4-dihydro · 6-ethoxy-2,2,4-trimethyl-3,4-dihydro-1H-quinoline · 2,2,4-Trimethyl-6-ethoxy-1,2,3,4-tetrahydroquinoline · 1,2,3,4-Tetrahydro-2,2,4-trimethyl-6-ethoxyquinoline · 6-ethoxy-1,2,3,4-tetrahydro-2,2,4-trimethylquinoline · 6-Ethoxy-1,2,3,4-tetrahydro-2,2,4-trimethylquinoline,97% · 6-ethoxy-2,2,4-trimethyl-1,2,3,4-tetrahydroquinoline hydrobromide

https://huagongshe.com/de/chemical/86013

Molekülstruktur von 6-Ethoxy-1,2,3,4-tetrahydro-2,2,4-trimethylchinolin

Identifikatoren & physikalische Daten

CAS No.	16489-90-0
Summenformel	C14H21NO
Durchschnittliche Molmasse	219,32 g/mol
Monoisotopische Masse	219,16231429 g/mol
SMILES	CCOc1ccc2c(c1)C(C)CC(C)(C)N2
InChIKey	YLDDCEXDGNXCIO-UHFFFAOYSA-N
PubChem CID	86013
ChEMBL	CHEMBL176666
EC No.	240-546-9
DTXSID	DTXSID6042365
Lokaler Name	6-Ethoxy-1,2,3,4-tetrahydro-2,2,4-trimethylchinolin

Chemische & physikalische Eigenschaften

XLogP	3,6
Polarare Oberfläche (TPSA)	21,3
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	2
Schwere Atome	16
Formalladung	0
Komplexität	239
Schmelzpunkt	38-39 °C(Solv: hexane (110-54-3))
Siedepunkt	122 °C(Press: 2 Torr)
Dichte	0.948±0.06 g/cm3(Predicted)
pKa (Säurekonstante)	6.16±0.60(Predicted)
EPA chemische Informationen	Quinoline, 6-ethoxy-1,2,3,4-tetrahydro-2,2,4-trimethyl- (16489-90-0)

Sicherheit & Vorschriften

GHS-Einstufung	WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 41 reports by companies from 3 notifications to the ECHA C&L Inventory.
Hazard Classes and Categories	Acute Tox. 4 (100%)
Gefahrenklasse	IRRITANT