tert-Butyl 2,8-diazaspiro[4.5]decane-2-carboxylate

HCID 34178604CAS 336191-17-4

Grundinformationen

Standard-SMILES
CC(C)(C)OC(=O)N1CCC2(CCNCC2)C1
InChIKey
NFNCPNAVNRBDOU-UHFFFAOYSA-N
Summenformel
C13H24N2O2
Durchschnittliche Molmasse
240,34 g/mol
Monoisotopische Masse
240,18377801

Namen und Bezeichner

Bevorzugter Name
tert-Butyl 2,8-diazaspiro[4.5]decane-2-carboxylate
IUPAC
tert-butyl 2,8-diazaspiro[4.5]decane-2-carboxylate
Englischer Name
tert-Butyl 2,8-diazaspiro[4.5]decane-2-carboxylate
Summenformel
C13H24N2O2
Molmasse
240.34

Namen und Synonyme

336191-17-4tert-butyl 2,8-diazaspiro[4.5]decane-2-carboxylateDTXSID00653030tert-Butyl 2,8-diazaspiro(4.5)decane-2-carboxylateRefChem:383142DTXCID30603780817-976-62,8-Diaza-spiro[4.5]decane-2-carboxylic acid tert-butyl ester2-Boc-2,8-diazaspiro[4.5]decane2-Boc-2,8-diaza-spiro[4.5]decaneMFCD067390562,8-Diazaspiro[4.5]decane-2-carboxylic acid tert-butyl ester
Weitere Namen anzeigen
2-Boc-2,8-diaza-spiro[4.5...2-N-Boc-2,8-diaza-spiro[4.5]decane2,8-Diazaspiro[4.5]decane, N2-BOC protected2-Boc-2,8-diazaspiro[4.5]decane hemioxalatetert-Butyl 2,8-diazaspiro4.5decan-2-carboxylateert-Butyl2,8-diazaspiro[4.5]decane-2-carboxylatetert-Butyl 3,8-diazaspiro[4.5]decane-3-carboxylatetert-Butyl2,7-diazaspiro[4,5]decane-2-carboxylate,98%
2,8-DIAZASPIRO[4.5]DECANE-2-CARBOXYLIC ACID, 1,1-DIMETHYLETHYL ESTER2,8-DIAZA-SPIRO[4.5]DECANE-2-CARBOXYLIC ACID TERT-BUTYL ESTER;TERT-BUTYL 2,8-DIAZASPIRO[4.5]DECANE-2-CARBOXYLATE;2-Boc-2,8-Diaza-spiro[4.5]decane;tert-Butyl2,7-diazaspiro[4,5]decane-2-carboxylate,98%SCHEMBL484311orb3031657NFNCPNAVNRBDOU-UHFFFAOYSA-NFL0238SBB099302AKOS005069264

Datenbank-Bezeichner

CAS
336191-17-4
PubChem CID
34178604
DTXSID
DTXSID00653030
EC Number
817-976-6

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,4
Polarare Oberfläche (TPSA)
41,6 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
2
Schwere Atome
17

Physikochemische Eigenschaften

Siedepunkt
337 · 337.0±35.0 °C(Predicted)
Dichte
1.07 · 1.07±0.1 g/cm3(Predicted)
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
pka
10.97 · 10.97±0.20(Predicted)
Aggregatzustand
solid
Farbe
Off-white to grey

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Sicherheitsdaten

hs_code
29339900
risk_code
20-22-36/37/38
safety_code
26-36
hazard_class
IRRITANT

Chemie und Industrie

Anwendungen

Verwendentert-Butyl 2,8-diazaspiro[4.5]decane-2-carboxylate is a heterocyclic derivative and can be used as a pharmaceutical synthesis intermediate.

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