ChemicalBook--->CAS DataBase List--->85908-96-9

85908-96-9

85908-96-9 Structure

85908-96-9 Structure
IdentificationMore
[Name]

N-Boc-2-piperidone
[CAS]

85908-96-9
[Synonyms]

1-BOC-1-AZACYCLOHEXAN-2-ONE
1-BOC-2-PIPERIDONE
1-N-BOC-2-PIPERIDONE
N-BOC-2-PIPERIDONE
N-BOC-DELTA-VALEROLACTAM
N-(TERT-BUTOXYCARBONYL)-2-PIPERIDONE
N-(TERT-BUTYLOXYCARBONYL)-2-PIPERIDONE
1-(tert-Butoxycarbonyl)-2-piperidone~tert-Butyl 2-oxo-1-piperidinecarboxylate
1-Boc-2-pieridone
1-(Tert-butoxycarbonyl)-2-piperidone
Tert-butyl-2-oxo-1-piperidinecarboxylate
1-Piperidinecarboxylic acid, 2-oxo-, 1,1-dimethylethyl ester
1-BOC-2-OXOPIPERIDINE
tert-butyl 2-oxopiperidine-1-carboxylate
[Molecular Formula]

C10H17NO3
[MDL Number]

MFCD02179046
[Molecular Weight]

199.25
[MOL File]

85908-96-9.mol
Chemical PropertiesBack Directory
[Melting point ]

29-36 °C
[Boiling point ]

110°C/0.1mmHg(lit.)
[density ]

1.099±0.06 g/cm3(Predicted)
[Fp ]

>110 °C
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[solubility ]

Chloroform, Methanol
[form ]

Solid
[pka]

-2.29±0.20(Predicted)
[color ]

Off-White
[BRN ]

4674955
[InChI]

InChI=1S/C10H17NO3/c1-10(2,3)14-9(13)11-7-5-4-6-8(11)12/h4-7H2,1-3H3
[InChIKey]

ULMHMJAEGZPQRY-UHFFFAOYSA-N
[SMILES]

N1(C(OC(C)(C)C)=O)CCCCC1=O
[CAS DataBase Reference]

85908-96-9(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

N
[Risk Statements ]

R50:Very Toxic to aquatic organisms.
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
[RIDADR ]

UN 3082
[WGK Germany ]

3
[HazardClass ]

IRRITANT
[HS Code ]

29337900
Raw materials And Preparation ProductsBack Directory
[Raw materials]

N-Benzyl-4-piperidone
[Preparation Products]

N-Boc-3,4-dihydro-2H-pyridine
Hazard InformationBack Directory
[Chemical Properties]

Off-White Low Melting Solid
[Uses]

N-Boc-2-piperidone(85908-96-9) is used as a synthetic intermediate in the preparation of various biological inhibitors.
[Definition]

ChEBI: Piperidin-2-one N-protected by t-Boc.
[Preparation]

4-Benzensulfonylmethyl-4-hydroxy-piperidine TFA (B-1) Diisopropylethylamine (28.3 mL, 162.75 mmol) and di-t-butyl dicarbonate (28.4 g, 130.02 mmol) were added in sequence to a mixture of piperidone hydrate hydrochloride (12) (10.0 g, 65.1 mmol) in methanol (50 mL).  The mixture was stirred at room temperature for 20 hours. After that, removed the solvent  and the remaining was separated with ether and 1 M KHSO4 solution.  The organic layer was washed with brine and saturated NaHCO3.  Finally, N-Boc-2-piperidone was obtained after purification.
N-Boc-2-piperidone
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

1-Boc-2-piperidone, 99%(85908-96-9)
[Sigma Aldrich]

85908-96-9(sigmaaldrich)
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