ChemicalBook--->CAS DataBase List--->1393330-41-0

1393330-41-0

1393330-41-0 Structure

1393330-41-0 Structure
IdentificationBack Directory
[Name]

Bromo-PEG6-t-butyl ester
[CAS]

1393330-41-0
[Synonyms]

Br-PEG6-COOtBu
Bromo-PEG6-Boc
Br-PEG6-t-butyl
CAS_1393330-41-0
Br-PEG6-CH2CH2COOtBu
Br-PEG6-t-butyl ester
Bromo-PEG6-t-butyl ester
Bromo-PEG7-t-butyl ester
tert-butyl 1-bromo-3,6,9,12,15,18-hexaoxahenicosan-21-oate
4,7,10,13,16,19-Hexaoxaheneicosanoic acid, 21-bromo-, 1,1-dimethylethyl ester
[Molecular Formula]

C19 H37 Br O8
[MDL Number]

MFCD22574809
[MOL File]

1393330-41-0.mol
[Molecular Weight]

473.4
Chemical PropertiesBack Directory
[Boiling point ]

489.9±40.0 °C(Predicted)
[density ]

1.192±0.06 g/cm3(Predicted)
[form ]

Liquid
[color ]

Colorless to light yellow
[InChI]

InChI=1S/C19H37BrO8/c1-19(2,3)28-18(21)4-6-22-8-10-24-12-14-26-16-17-27-15-13-25-11-9-23-7-5-20/h4-17H2,1-3H3
[InChIKey]

MCRDORXGTMATBG-UHFFFAOYSA-N
[SMILES]

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

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362-P403+P233-P501
Hazard InformationBack Directory
[Description]

Bromo-PEG6-t-butyl ester is a PEG linker containing a bromide group and a t-butyl protected carboxyl group. The hydrophilic PEG spacer increases solubility in aqueous media. The bromide (Br) is a very good leaving group for nucleophilic substitution reactions. The t-butyl protected carboxyl group can be deprotected under acidic conditions.
[Uses]

Bromo-PEG6-Boc 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]

Bromo-PEG6-t-butyl ester(1393330-41-0)1HNMR
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