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ChemicalBook--->CAS DataBase List--->135065-71-3

135065-71-3

135065-71-3 Structure

135065-71-3 Structure
IdentificationBack Directory
[Name]

(R)-N-Boc-2-Hydroxymethylmorpholine
[CAS]

135065-71-3
[Synonyms]

(R)-N-BOC-2-HYDROXYMETHYLMORPHOLINE
(R)-4-BOC-2-HYDROXYMETHYL-MORPHOLINE
(R)-2-hydroxyMethyl-4-BOC-Morpholine
(R)-N-Boc-2-hydroxymethylmorpholine,99%
(R)/(S)-N-Boc-2-hydroxymethylmorpholine
(R)-N-Boc-2-hydroxymethylmorpholine,99%e.e.
(R)-4-t-butoxycarbonyl-2-(hydroxymethyl)morpholine
Tert-Butyl(R)-2-(Hydroxymethyl)Morpholine-4-Carboxylate
(R)-N-Boc-2-Hydroxymethylmorpholine ISO 9001:2015 REACH
tert-butyl (2R)-2-(hydroxymethyl)morpholine-4-carboxylate
tert-Butyl (2R)-2-(hydroxymethyl)morpholine-4-carboxylate 95+%
(R)-2-Hydroxymethylmorpholine-4-carboxylic acid tert-butyl ester
2-(Hydroxymethyl)morpholine-4-carboxylic acid (R)-tert-butyl ester
(2R)-2-(Hydroxymethyl)-4-morpholinecarboxylic acid tert-butyl ester
4-Morpholinecarboxylic acid, 2-(hydroxyMethyl)-, 1,1-diMethylethyl ester, (2R)-
[Molecular Formula]

C10H19NO4
[MDL Number]

MFCD09260605
[MOL File]

135065-71-3.mol
[Molecular Weight]

217.26
Chemical PropertiesBack Directory
[Melting point ]

59-61 °C
[Boiling point ]

321 °C
[density ]

1.118
[Fp ]

148 °C
[storage temp. ]

Inert atmosphere,2-8°C
[pka]

14.36±0.10(Predicted)
[InChI]

InChI=1S/C10H19NO4/c1-10(2,3)15-9(13)11-4-5-14-8(6-11)7-12/h8,12H,4-7H2,1-3H3/t8-/m1/s1
[InChIKey]

FJYBLMJHXRWDAQ-MRVPVSSYSA-N
[SMILES]

N1(C(OC(C)(C)C)=O)CCO[C@@H](CO)C1
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P280a-P304+P340-P305+P351+P338-P405-P501a
[HS Code ]

2934999090
Hazard InformationBack Directory
[Uses]

(R)-N-Boc-2-hydroxymethylmorpholine is used for preparation of inhibitors of Checkpoint Kinase 1 through template screening.
[Synthesis]

(R)-tert-butyl 2-((benzyloxy)methyl)morpholine-4-carboxylate

135097-68-6

(R)-N-Boc-2-Hydroxymethylmorpholine

135065-71-3

Intermediate 111 (19.8 g, 64.4 mmol) was stirred and reacted for 16 h under hydrogen atmosphere with 10% Pd/C (1.98 g, 1.86 mmol) as catalyst. Upon completion of the reaction, the catalyst was removed by vacuum filtration and the filtrate was concentrated under reduced pressure to afford 13.98 g (100% yield) of (R)-N-Boc-2-hydroxymethylmorpholine, the product was a colorless viscous oil that crystallized upon standing. The 1H NMR (250 MHz, chloroform-d) data of the product were as follows: δ [ppm] 3.98 - 3.75 (m, 3H), 3.73 - 3.41 (m, 4H), 3.03 - 2.83 (m, 1H), 2.82 - 2.65 (m, 1H), 2.12 (t, J = 5.9 Hz, 1H), 1.45 (s, 9H).

[References]

[1] Heterocycles, 1993, vol. 35, # 1, p. 105 - 109
[2] Patent: WO2016/91776, 2016, A1. Location in patent: Page/Page column 290
[3] Patent: WO2008/124575, 2008, A1. Location in patent: Page/Page column 112; 113-114
[4] Patent: US2010/184805, 2010, A1. Location in patent: Page/Page column 30-31
[5] Patent: WO2007/70201, 2007, A1. Location in patent: Page/Page column 176
Spectrum DetailBack Directory
[Spectrum Detail]

(R)-N-Boc-2-Hydroxymethylmorpholine(135065-71-3)1HNMR
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