2-Tert-butyl 1-ethyl 6-hydroxy-1,2,3,4-tetrahydroisoquinoline-1,2-dicarboxylate
Grundinformationen
- CAS
128073-49-4- Standard-SMILES
CCOC(=O)C1c2ccc(O)cc2CCN1C(=O)OC(C)(C)C- InChIKey
HOPREPHTFMBXEI-UHFFFAOYSA-N- Summenformel
- C17H23NO5
- Durchschnittliche Molmasse
- 321,4 g/mol
Namen und Bezeichner
- Bevorzugter Name
- 2-Tert-butyl 1-ethyl 6-hydroxy-1,2,3,4-tetrahydroisoquinoline-1,2-dicarboxylate
- IUPAC
- 2-O-tert-butyl 1-O-ethyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate
- Englischer Name
- 2-tert-butyl 1-ethyl 3,4-dihydro-6-hydroxyisoquinoline-1,2(1H)-dicarboxylate
- Summenformel
- C17H23NO5
- Molmasse
- 321.37
Namen und Synonyme
128073-49-42-tert-butyl 1-ethyl 6-hydroxy-1,2,3,4-tetrahydroisoquinoline-1,2-dicarboxylateRefChem:483577826-713-42-tert-Butyl 1-ethyl 6-hydroxy-3,4-dihydroisoquinoline-1,2(1H)-dicarboxylateMFCD244667032-(tert-butyl) 1-ethyl 6-hydroxy-3,4-dihydroisoquinoline-1,2(1H)-dicarboxylate2-O-tert-butyl 1-O-ethyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate1,2(1H)-Isoquinolinedicarboxylic acid, 3,4-dihydro-6-hydroxy-,2-(1,1-dimethylethyl) 1-ethyl esterSCHEMBL2081445HOPREPHTFMBXEI-UHFFFAOYSA-NDA-25670
Weitere Namen anzeigen
2-tert-butyl 1-ethyl 3,4-dihydro-6-hydroxyisoquinoline-1,2(1H)-dicarboxylate6-HYDROXY-3,4-DIHYDRO-1H-ISOQUINOLINE-1,2-DICARBOXYLIC ACID 2-TERT-BUTYL ESTER 1-ETHYL ESTER
EN300-344211Z15086909042-t-butyl 1-ethyl 6-hydroxy-3,4-dihydroisoquinoline-1,2(1H)-dicarboxylate2-tert-Butyl1-ethyl6-hydroxy-3,4-dihydroisoquinoline-1,2(1H)-dicarboxylate1-ethyl 2-tert-butyl 6-hydroxy-3,4-dihydroisoquinoline-1,2 (1H)-dicarboxylate1-ethyl 2-tert-butyl 6-hydroxy-3,4-dihydroisoquinoline-1,2(1H)-dicarboxylate2-(t-Butyl) 1-ethyl 6-hydroxy-3,4-dihydroisoquinoline-1,2(1H)-dicarboxylateO2-tert-butyl O1-ethyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,8
- Polarare Oberfläche (TPSA)
- 76,1 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 5
- Schwere Atome
- 23
- Formalladung
- 0
- Komplexität
- 445
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H315 (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 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- Alarmwort
- Warnung
- Gefahrenhinweise
- Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H315
Chemie und Industrie
Anbieter11 Anbieter
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
海济医药科技（苏州）有限公司18012778619 · [email protected]
上海敏寒医药科技有限公司17612188245 · [email protected]
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