tert-Butyl 4-hydroxy-3,3-dimethylpiperidine-1-carboxylate

HCID 53393265CAS 143306-65-4
TeilstruktursucheÄhnliche Strukturen suchen

Grundinformationen

Standard-SMILES
CC(C)(C)OC(=O)N1CCC(O)C(C)(C)C1
InChIKey
QZMUVNRDYLNZDA-UHFFFAOYSA-N
Summenformel
C12H23NO3
Durchschnittliche Molmasse
229,32 g/mol
Monoisotopische Masse
229,1677936

Namen und Bezeichner

Bevorzugter Name
tert-Butyl 4-hydroxy-3,3-dimethylpiperidine-1-carboxylate
IUPAC
tert-butyl 4-hydroxy-3,3-dimethylpiperidine-1-carboxylate
Englischer Name
1-Piperidinecarboxylic acid, 4-hydroxy-3,3-dimethyl-, 1,1-dimethylethyl ester
Summenformel
C12H23NO3
Molmasse
229.32

Namen und Synonyme

143306-65-4TERT-BUTYL 4-HYDROXY-3,3-DIMETHYLPIPERIDINE-1-CARBOXYLATEDTXSID30693848RefChem:894061DTXCID30644597852-518-91-Boc-4-hydroxy-3,3-dimethylpiperidineMFCD119773434-Hydroxy-3,3-diMethyl-1-piperidinecarboxylic Acid 1,1-DiMethylethyl Ester1-Boc-3,3-dimethylpiperidin-4-ol1-Piperidinecarboxylic acid, 4-hydroxy-3,3-dimethyl-, 1,1-dimethylethyl esterSCHEMBL2777507
Weitere Namen anzeigen
1-Piperidinecarboxylicacid, 4-hydroxy-3,3-dimethyl-, 1,1-dim...4-hydroxy-3,3-diMethyl-1-piperidinecarboxylic acid tert-butyl ester
QZMUVNRDYLNZDA-UHFFFAOYSA-NTFA30665AKOS015897865SB11750AS-34002SY042404CS-0048212EN300-206514

Datenbank-Bezeichner

CAS
143306-65-4
PubChem CID
53393265
DTXSID
DTXSID30693848
EC Number
852-518-9

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,8
Polarare Oberfläche (TPSA)
49,8 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
2
Schwere Atome
16

Physikochemische Eigenschaften

Siedepunkt
306.3 · 306.3±35.0 °C(Predicted)
Dichte
1.041 · 1.041±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
Aggregatzustand
solid
pka
14.85 · 14.85±0.40(Predicted)
InChI
1S/C12H23NO3/c1-11(2,3)16-10(15)13-7-6-9(14)12(4,5)8-13/h9,14H,6-8H2,1-5H3

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P316, 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. 3 (100%)

Sicherheitsdaten

ridadr
UN2811
Speicherklasse
6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
Hazard Classifications
Acute Tox. 3 Oral

Chemie und Industrie

Anwendungen

Verwenden4-Hydroxy-3,3-dimethyl-1-piperidinecarboxylic Acid 1,1-Dimethylethyl Ester is a useful synthetic intermediate. It can be used to prepare hydroxyquinoxalinecarboxamides for treatment of blood coagulation disorders.

Anbieter37 Anbieter

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Compound Net Biotechnology Inc.15266686121 · [email protected]

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