| Identification | More | [Name]
(S)-1-Boc-3-hydroxypiperidine | [CAS]
143900-44-1 | [Synonyms]
1-PIPERIDINECARBOXYLIC ACID, 3-HYDROXY-, 1,1-DIMETHYLETHYL ESTER, (3S)-
(S)-1-BOC-3-HYDROXYPIPERIDINE
(S)-1-BOC-3-PIPERIDINOL
(S)-1-N-BOC-3-HYDROXY-PIPERIDINE
(S)-3-HYDROXY-1-(TERT-BUTOXYCARBONYL)PIPERIDINE
(S)-3-HYDROXY-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
(S)-N-BOC-3-HYDROXY PIPERIDINE
(S)-N-(TERT-BUTOXYCARBONYL)-3-HYDROXYPIPERIDINE HYDROCHLORIDE
(S)-TERT BUTYL-3-HYDROXYPIPERIDINE-1-CARBOXYLATE
(S)-1-TERT-BUTOXYCARBONYL-3-HYDROXYPIPERIDINE
(S)-N-tert-Butoxycarbonyl-3-hydroxypiperidine
(S)-3-Hydroxypiperidine, N-BOC protected
(S)-1-BOC-Piperidin-3-ol | [EINECS(EC#)]
1308068-626-2 | [Molecular Formula]
C10H19NO3 | [MDL Number]
MFCD06659041 | [Molecular Weight]
201.26 | [MOL File]
143900-44-1.mol |
| Chemical Properties | Back Directory | [Melting point ]
34-40 °C | [Boiling point ]
292.3±33.0 °C(Predicted) | [density ]
1.107±0.06 g/cm3(Predicted) | [Fp ]
110 °C | [storage temp. ]
Keep in dark place,Sealed in dry,Room Temperature | [solubility ]
Soluble in methanol. | [form ]
Powder or Crystalline Powder | [pka]
14.74±0.20(Predicted) | [color ]
White to tan | [optical activity]
[α]22/D +10.0°, c = 1 in chloroform | [InChI]
InChI=1S/C10H19NO3/c1-10(2,3)14-9(13)11-6-4-5-8(12)7-11/h8,12H,4-7H2,1-3H3/t8-/m0/s1 | [InChIKey]
UIJXHKXIOCDSEB-QMMMGPOBSA-N | [SMILES]
N1(C(OC(C)(C)C)=O)CCC[C@H](O)C1 | [CAS DataBase Reference]
143900-44-1(CAS DataBase Reference) |
| Questions And Answer | Back Directory | [Uses]
(S)-1-Boc-3-hydroxypiperidine is an important chiral intermediate for the synthesis of ibrutinib, an anticancer drug targeting B-cell malignancies. Synthesis of pharmaceutical intermediates including ibrutinib, the API of the newly approved drug Imbruvica, for the treatment of lymphoma. |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection . | [WGK Germany ]
3 | [HS Code ]
29333990 |
| Hazard Information | Back Directory | [Description]
(S)-1-Boc-3-hydroxypiperidine, alias (S)-N-Boc-3-hydroxypiperidine (S-NBHP) is an important chiral intermediate for the synthesis of ibrutinib, an anticancer drug targeting B-cell malignancies.S-NBHP can be prepared in a variety of ways such as chemically or biocatalytically. S-NBHP can be prepared in various ways, such as chemical synthesis or biocatalysis. Biocatalysis is an efficient process for the reduction of N-Boc-piperidin-3-one by recombinant keto reductase (KRED) catalytic to obtain optically pure S-NBHP using 99% yield. The asymmetric reduction of N-Boc-piperidin-3-one (NBPO) to (S)-NBHP can also be catalysed by a reductase (YDR541C) isolated from Saccharomyces cerevisiae in 99% yield. | [Chemical Properties]
White powder |
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