5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid

5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid · AKOS MSC-0168 · 5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-2-naphthoic acid · 5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carboxylic acid · 5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-2-naphthalenecarboxylic a · 5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-2-naphthalenecarboxylic acid · 5,5,8,8-tetraMethyl-5,6,7,8-tetrahydro-naphthalen-2-carboxylic acid · 5,6,7,8-Tetrahydro-5,5,8,8-tetramethyl-2-naphthalenecarboxylic acid

https://huagongshe.com/de/chemical/227638

Molekülstruktur von 5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid

Identifikatoren & physikalische Daten

CAS No.	103031-30-7
Summenformel	C15H20O2
Durchschnittliche Molmasse	232,32 g/mol
Monoisotopische Masse	232,14632988 g/mol
SMILES	CC1(C)CCC(C)(C)c2cc(C(=O)O)ccc21
InChIKey	KSEZYZSBKCPEKP-UHFFFAOYSA-N
PubChem CID	227638
ChEMBL	CHEMBL552060
EC No.	869-444-8
DTXSID	DTXSID60280982

Chemische & physikalische Eigenschaften

XLogP	4,6
Polarare Oberfläche (TPSA)	37,3
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	1
Schwere Atome	17
Formalladung	0
Komplexität	317
Lagerbedingungen	2-8°C

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)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard Classes and Categories	Skin Irrit. 2 (100%)
Alarmwort	Warnung
Gefahrenhinweise	Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H315

Anwendungen & Verwendung

Verwenden

5,5,8,8-Tetramethyl-5,6,7,8-Tetrahydronaphthalene-2-Carboxylic Acid is used in preparation of Tetrahydronaphthalenesulfonamides as CYP26 enzyme inhibitors.