tert-Butyl 1H-spiro[isoquinoline-4,4'-piperidine]-2(3H)-carboxylate
Grundinformationen
- CAS
857898-70-5- Standard-SMILES
CC(C)(C)OC(=O)N1Cc2ccccc2C2(CCNCC2)C1- InChIKey
PYRPHEQXDLNURT-UHFFFAOYSA-N- Summenformel
- C18H26N2O2
- Durchschnittliche Molmasse
- 302,4 g/mol
- Monoisotopische Masse
- 302,19942808
Namen und Bezeichner
- Bevorzugter Name
- tert-Butyl 1H-spiro[isoquinoline-4,4'-piperidine]-2(3H)-carboxylate
- IUPAC
- tert-butyl spiro[1,3-dihydroisoquinoline-4,4'-piperidine]-2-carboxylate
- Englischer Name
- tert-Butyl 1H-spiro[isoquinoline-4,4'-piperidine]-2(3H)-carboxylate
- Summenformel
- C18H26N2O2
- Molmasse
- 302.41
Namen und Synonyme
857898-70-5tert-Butyl 1H-spiro[isoquinoline-4,4'-piperidine]-2(3H)-carboxylatetert-butyl spiro[1,3-dihydroisoquinoline-4,4'-piperidine]-2-carboxylateMFCD09959723tert-butyl 2,3-dihydro-1H-spiro[isoquinoline-4,4'-piperidine]-2-carboxylatetert-butyl spiro[1,3-dihydroisoquinoline-4,4-piperidine]-2-carboxylateSCHEMBL652952DTXSID10678294PYRPHEQXDLNURT-UHFFFAOYSA-NAKOS015900714PB25255AS-50688
Weitere Namen anzeigen
2-Boc-2,3-dihydro-1H-spiro[isoquinoline-4,4’-piperidinetert-Butyl 1H-spiro[isoquinoline-4,4'-piperidine]-2(3H)-carboxylate - [B15455]Spiro[isoquinoline-4(1H),4'-piperidine]-2(3H)-carboxylic acid tert-butyl esterSpiro[isoquinoline-4(1H),4'-piperidine]-2(3H)-carboxylic acid, 1,1-dimethylethyl ester
SY046819DB-076444CS-0048452P10874EN300-3442705t-Butyl 1H-spiro[isoquinoline-4,4'-piperidine]-2(3H)-carboxylate2-Boc-2,3-dihydro-1H-spiro[isoquinoline-4,4 inverted exclamation mark -piperidine]
Datenbank-Bezeichner
- CAS
857898-70-5- PubChem CID
- 49760902
- DTXSID
DTXSID10678294
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,5
- Polarare Oberfläche (TPSA)
- 41,6 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 22
- Formalladung
- 0
- Komplexität
- 410
Physikochemische Eigenschaften
- Siedepunkt
- 428 ℃ · 428℃
- Dichte
- 1.13 · 1.13
- Flammpunkt
- 213 ℃ · 213℃
- storage temp.
- 2 · 2-8°C
Sicherheit und Regulatorisches
Sicherheitsdaten
- hs_code
- 29334900
Chemie und Industrie
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