7-Methoxy-1,2,3,4-Tetrahydroisoquinoline

m90105 · AKOS BB-9298 · 7-Methoxy-1,2,3,4-tetrahydro-isoquinoline · Isoquinoline, 1,2,3,4-tetrahydro-7-methoxy- · 4-tetrahydro-7-Methoxyisoquinoline hydrochloride · 7-Methoxy-1,2,3,4-tetrahydro-isoquinoline 1HCl salt · 1,2,3,4-tetrahydro-7-methoxyisoquinoline hydrochloride

https://huagongshe.com/de/chemical/417288

Molekülstruktur von 7-Methoxy-1,2,3,4-Tetrahydroisoquinoline

Identifikatoren & physikalische Daten

CAS No.	43207-78-9
Summenformel	C10H13NO
Durchschnittliche Molmasse	163,22 g/mol
Monoisotopische Masse	163,09971404 g/mol
SMILES	COc1ccc2c(c1)CNCC2
InChIKey	BPSLFSXCUJYFIR-UHFFFAOYSA-N
PubChem CID	417288
ChEMBL	CHEMBL26640
EC No.	824-626-6
DTXSID	DTXSID50329096

Chemische & physikalische Eigenschaften

XLogP	1,3
Polarare Oberfläche (TPSA)	21,3
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	1
Schwere Atome	12
Formalladung	0
Komplexität	149
Schmelzpunkt	190 °C
Siedepunkt	184-186 °C(Press: 50 Torr)
Dichte	1.044±0.06 g/cm3(Predicted)
Lagerbedingungen	Keep in dark place,Sealed in dry,Room Temperature
pKa (Säurekonstante)	9.73±0.20(Predicted)

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)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard Classes and Categories	Acute Tox. 4 (100%)
Alarmwort	Warnung
Gefahrenhinweise	Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302