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HCID 95477Erstellt: 5. November 2026

1,2,3,4-Tetrahydrobenzo[h]chinolin-3-ol

1,2,3,4-Tetrahydrobenzo[h]quinolin-3-ol · 4-Tetrahydrobenzo[h]quinolin-3-ol · 1H,2H,3H,4H-benzo[h]quinolin-3-ol · Benzo[h]quinolin-3-ol, 1,2,3,4-tetrahydro- · (3R)-1,2,3,4-tetrahydrobenzo[h]quinolin-3-ol · 3-HYDROXY-1,2,3,4-TETRAHYDROBENZO[H]QUINOLINE · 3-Hydroxy1,2,3,4 tetrahydrobenzo H quinolin3ol · 3-Hydroxy-1,2,3,4-tetrahydrobenzo-[h]-chinolin Hydrochlorid

https://huagongshe.com/de/chemical/95477

Molekülstruktur von 1,2,3,4-Tetrahydrobenzo[h]chinolin-3-ol

Identifikatoren & physikalische Daten

CAS No.	5423-67-6
Summenformel	C13H13NO
Durchschnittliche Molmasse	199,25 g/mol
Monoisotopische Masse	199,09971404 g/mol
SMILES	OC1CNc2c(ccc3ccccc23)C1
InChIKey	WKJMQLMWPMZUQH-UHFFFAOYSA-N
PubChem CID	95477
ChEMBL	CHEMBL1868082
EC No.	226-556-6
DTXSID	DTXSID401252939
Lokaler Name	1,2,3,4-Tetrahydrobenzo[h]chinolin-3-ol

Chemische & physikalische Eigenschaften

XLogP	2,6
Polarare Oberfläche (TPSA)	32,3
H-Brücken-Donoren	2
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	0
Schwere Atome	15
Formalladung	0
Komplexität	231
Schmelzpunkt	148-150 °C
Siedepunkt	424.3±34.0 °C(Predicted)
Dichte	1.219±0.06 g/cm3(Predicted)
Lagerbedingungen	Keep in dark place,Sealed in dry,Room Temperature
Aggregatzustand	Solid
pKa (Säurekonstante)	14.33±0.20(Predicted)
Farbe	Off-white to gray
InChI	InChI=1S/C13H13NO/c15-11-7-10-6-5-9-3-1-2-4-12(9)13(10)14-8-11/h1-6,11,14-15H,7-8H2
InChIKey	WKJMQLMWPMZUQH-UHFFFAOYSA-N
SMILES	N1C2=C(C=CC3=CC=CC=C32)CC(O)C1

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 53 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Skin Irrit. 2 (100%)
Zollcode	29334900
Sicherheitshinweise (S)	24/25

1,2,3,4-Tetrahydrobenzo[h]chinolin-3-ol

CAS No.

5423-67-6

Summenformel

C13H13NO

Durchschnittliche Molmasse

199,25 g/mol

Monoisotopische Masse

199,09971404 g/mol

SMILES

OC1CNc2c(ccc3ccccc23)C1

InChIKey

WKJMQLMWPMZUQH-UHFFFAOYSA-N

PubChem CID

95477

ChEMBL

CHEMBL1868082

EC No.

226-556-6

DTXSID

DTXSID401252939

Lokaler Name

1,2,3,4-Tetrahydrobenzo[h]chinolin-3-ol

Chemische & physikalische Eigenschaften

XLogP

2,6

Polarare Oberfläche (TPSA)

32,3

H-Brücken-Donoren

H-Brücken-Akzeptoren

Frei drehbare Bindungen

Schwere Atome

Formalladung

Komplexität

231

Schmelzpunkt

148-150 °C

Siedepunkt

424.3±34.0 °C(Predicted)

Dichte

1.219±0.06 g/cm3(Predicted)

Lagerbedingungen

Keep in dark place,Sealed in dry,Room Temperature

Aggregatzustand

Solid

pKa (Säurekonstante)

14.33±0.20(Predicted)

Farbe

Off-white to gray

InChI

InChI=1S/C13H13NO/c15-11-7-10-6-5-9-3-1-2-4-12(9)13(10)14-8-11/h1-6,11,14-15H,7-8H2

InChIKey

WKJMQLMWPMZUQH-UHFFFAOYSA-N

SMILES

N1C2=C(C=CC3=CC=CC=C32)CC(O)C1

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 53 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard Classes and Categories

Skin Irrit. 2 (100%)

Zollcode

29334900

Sicherheitshinweise (S)

24/25