ChemicalBook--->CAS DataBase List--->1404111-67-6

1404111-67-6

1404111-67-6 Structure

1404111-67-6 Structure
IdentificationBack Directory
[Name]

N-Boc-PEG5-alcohol
[CAS]

1404111-67-6
[Synonyms]

NHBoc-PEG5-OH
Boc-NH-PEG5-OH
N-Boc-PEG5-alcoh
N-Boc-PEG5-alcohol
t-boc-N-amido-PEG5-alcohol
tert-Butyl (14-hydroxy-3,6,9,12-tetraoxatetradecyl)carbamate
tert-Butyl N-2-2-2-2-(2-hydroxyethoxy)ethoxyethoxyethoxyethylcarbamate
5,8,11,14-Tetraoxa-2-azahexadecanoic acid, 16-hydroxy-, 1,1-dimethylethyl ester
[Molecular Formula]

C15H31NO7
[MDL Number]

MFCD27635183
[MOL File]

1404111-67-6.mol
[Molecular Weight]

337.41
Chemical PropertiesBack Directory
[Boiling point ]

451.5±40.0 °C(Predicted)
[density ]

1.083±0.06 g/cm3(Predicted)
[solubility ]

Soluble in DCM, Methanol
[form ]

liquid
[pka]

12.23±0.46(Predicted)
[color ]

Colourless to light yellow
[InChI]

InChI=1S/C15H31NO7/c1-15(2,3)23-14(18)16-4-6-19-8-10-21-12-13-22-11-9-20-7-5-17/h17H,4-13H2,1-3H3,(H,16,18)
[InChIKey]

PBWLVPPLXJCLBC-UHFFFAOYSA-N
[SMILES]

C(OC(C)(C)C)(=O)NCCOCCOCCOCCOCCO
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P280-P305+P351+P338
[HS Code ]

2924190090
Hazard InformationBack Directory
[Description]

N-Boc-PEG5-alcohol is a PEG linker containing a hydroxyl group and Boc-protected amino group. The hydrophilic PEG spacer increases solubility in aqueous media. The hydroxyl group enables further derivatization or replacement with other reactive functional groups. The Boc group can be deprotected under mild acidic conditions to form the free amine.
[Uses]

N-Boc-PEG5-alcohol is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].
[IC 50]

PEGs; Alkyl/ether
[References]

[1] An S, et al. Small-molecule PROTACs: An emerging and promising approach for the development of targeted therapy drugs. EBioMedicine. 2018 Oct;36:553-562 DOI:10.1016/j.ebiom.2018.09.005
Spectrum DetailBack Directory
[Spectrum Detail]

N-Boc-PEG5-alcohol(1404111-67-6)1HNMR
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