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252990-05-9

252990-05-9 Structure

252990-05-9 Structure
IdentificationMore
[Name]

(R)-N-Boc-piperazine-2-carboxylic acid methyl ester
[CAS]

252990-05-9
[Synonyms]

[(2-N-BOC)PIPERAZINE(2R)COOH]-OME
(R)-1-N-BOC-PIPERAZINE-2-CARBOXYLIC ACID METHYL ESTER
(R)-1-TERT-BUTYL 2-METHYL PIPERAZINE-1,2-DICARBOXYLATE
(R)-PIPERAZINE-1,2-DICARBOXYLIC ACID 1-TERT-BUTYL ESTER 2-METHYL ESTER
(R)-Piperazine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl ester (R)-1-Boc-piperazine-2-carboxylic acid methyl ester
(R)-N-Boc-piperazine-2-carboxylic acid methyl ester
(R)-1--Boc-Piperazine-2-carboxylic acid methyl ester
[Molecular Formula]

C11H20N2O4
[MDL Number]

MFCD04115327
[Molecular Weight]

244.29
[MOL File]

252990-05-9.mol
Chemical PropertiesBack Directory
[Boiling point ]

321.3±37.0 °C(Predicted)
[density ]

1.118±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Sealed in dry,2-8°C
[pka]

7.25±0.40(Predicted)
[Appearance]

Colorless to light yellow Liquid
[InChI]

InChI=1S/C11H20N2O4/c1-11(2,3)17-10(15)13-6-5-12-7-8(13)9(14)16-4/h8,12H,5-7H2,1-4H3/t8-/m1/s1
[InChIKey]

BRXKHIPPSTYCKO-MRVPVSSYSA-N
[SMILES]

N1(C(OC(C)(C)C)=O)CCNC[C@@H]1C(OC)=O
[CAS DataBase Reference]

252990-05-9(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[HS Code ]

2933599590
Spectrum DetailBack Directory
[Spectrum Detail]

(R)-N-Boc-piperazine-2-carboxylic acid methyl ester(252990-05-9)1HNMR
Hazard InformationBack Directory
[Synthesis]

(R)-4-Boc-Piperazine-3-carboxylic acid

278788-60-6

(TRIMETHYLSILYL)DIAZOMETHANE

18107-18-1

(R)-N-Boc-piperazine-2-carboxylic acid methyl ester

252990-05-9

Trimethylsilylated diazomethane (2 M solution in hexane, 14 mL) was slowly added dropwise to a mixture of (R)-N-Boc-2-piperazinecarboxylic acid (5 g) dissolved in methanol (100 mL) and dichloromethane (115 mL). The reaction mixture was stirred at room temperature for 16 hours. Upon completion of the reaction, the solvent was removed by distillation under reduced pressure and the residue obtained was purified by column chromatography, first using ethyl acetate as eluent and subsequently using a solution of ethyl acetate containing 5% methanol and 7N ammonia as eluent to afford methyl (R)-1-Boc-2-piperazinecarboxylate as an oil (2.55 g, 48% yield). NMR hydrogen spectrum (DMSO-d6) δ 1.40 (s, 9H), 2.10 (bs, 1H), 2.52 (m, 1H), 2.72 (dd, 1H), 2.82 (d, 1H), 2.97 (m, 1H), 3.29 (d, 1H), 3.61 (d, 1H), 3.67 (s, 3H), 4.43 (m, 1H); mass spectrum showed the molecular ion peak MH+ 245.

[References]

[1] Patent: WO2005/26152, 2005, A1. Location in patent: Page/Page column 136
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