CAS 1148130-16-8 tert-Butyl 2,6-diethyl-4-oxopiperidine-1-carboxylate (HCID 44558577)

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Basic information

CAS: 1148130-16-8
Standard SMILES: CCC1CC(=O)CC(CC)N1C(=O)OC(C)(C)C
InChIKey: PRRQDRLRMZGMRO-UHFFFAOYSA-N
Molecular formula: C14H25NO3
Average molar mass: 255.35 g/mol
Monoisotopic mass: 255.18344366

Names & identifiers

Preferred name: tert-Butyl 2,6-diethyl-4-oxopiperidine-1-carboxylate
IUPAC: tert-butyl 2,6-diethyl-4-oxopiperidine-1-carboxylate
English name: tert-Butyl 2,6-diethyl-4-oxopiperidine-1-carboxylate
Molecular formula: C14H25NO3
Molecular weight: 255.35

Names & synonyms

1148130-16-8tert-Butyl 2,6-diethyl-4-oxopiperidine-1-carboxylate2,6-diethyl-4-oxo-piperidine-1-carboxylic acid tert-butyl ester1003843-31-9Trans-2,6-diethyl-4-oxo-piperidine-1-carboxylic acid tert-butyl estertrans-2,6-Diethyl-4-oxo-piperidine-1-carboxylicacidtert-butylester1-Piperidinecarboxylic acid, 2,6-diethyl-4-oxo-, 1,1-dimethylethyl esterN-Boc-2,6-diethyl-4-oxo-piperdinetert-Butyl2,6-diethyl-4-oxopiperidine-1-carboxylateSCHEMBL759059tert-butyl 2,6-diethyl-4-oxo-piperidine-1-carboxylate(2R,6R)-2,6-Diethyl-4-oxo-piperidine-1-carboxylicacidtert-butylester

Show more names

(2S,6S)-2,6-Diethyl-4-oxo-piperidine-1-carboxylicacidtert-butylesterDTXSID40659455PRRQDRLRMZGMRO-UHFFFAOYSA-NAKOS015909028SB30047SB30048SB30853SB35451

Database identifiers

Properties

Computed structural properties

XLogP: 2.5
Topological polar surface area: 46.6 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 4
Heavy atoms: 18
Formal charge: 0
Complexity: 303

Physicochemical properties

storage temp.: 2 · 2-8°C
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338