1,2,3,4-Tetrahydroisoquinolin-6-ol

H90100 · RMA-193 · 4-tetrahydro-isoquinolin-6-ol · 1,2,3,4-tetrahydro-6-isoquinolino · 1,2,3,4-Tetrahydro-6-isoquinolinol · 1,2,3,4-Tetrahydro-isoquinolin-6-ol · 6-Isoquinolinol, 1,2,3,4-tetrahydro- · 1,2,3,4-Tetrahydroisoquinolin-6-ol Name

https://huagongshe.com/de/chemical/26698

Molekülstruktur von 1,2,3,4-Tetrahydroisoquinolin-6-ol

Identifikatoren & physikalische Daten

CAS No.	14446-24-3
Summenformel	C9H11NO
Durchschnittliche Molmasse	149,19 g/mol
Monoisotopische Masse	149,08406397 g/mol
SMILES	Oc1ccc2c(c1)CCNC2
InChIKey	SCMZIFSYPJICCV-UHFFFAOYSA-N
PubChem CID	26698
ChEMBL	CHEMBL310736
EC No.	814-570-0
DTXSID	DTXSID80162711

Chemische & physikalische Eigenschaften

XLogP	1
Polarare Oberfläche (TPSA)	32,3
H-Brücken-Donoren	2
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	0
Schwere Atome	11
Formalladung	0
Komplexität	138
Schmelzpunkt	192-193℃
Siedepunkt	313.5±42.0 °C(Predicted)
Dichte	1.141±0.06 g/cm3(Predicted)
Lagerbedingungen	under inert gas (nitrogen or Argon) at 2–8 °C
Aggregatzustand	Solid
pKa (Säurekonstante)	9.30±0.20(Predicted)
Farbe	White to Light yellow
InChI	InChI=1S/C9H11NO/c11-9-2-1-8-6-10-4-3-7(8)5-9/h1-2,5,10-11H,3-4,6H2
InChIKey	SCMZIFSYPJICCV-UHFFFAOYSA-N
SMILES	C1C2=C(C=C(O)C=C2)CCN1
CAS Datenbank	14446-24-3(CAS DataBase Reference)

Sicherheit & Vorschriften

GHS-Einstufung	WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Skin Irrit. 2 (100%)
Zollcode	2933499090

Anwendungen & Verwendung

Verwenden

1,2,3,4-Tetrahydroisoquinolin-6-ol is a chemical reagent used in the organic synthesis. Used in the preparation of androgen receptor modulators (SARMs) as well as steroidmimetic and chimeric microtubule disruptors.