ChemicalBook--->CAS DataBase List--->91555-65-6

91555-65-6

91555-65-6 Structure

91555-65-6 Structure
IdentificationBack Directory
[Name]

3-[2-(Benzyloxy)ethoxy]propanoic acid
[CAS]

91555-65-6
[Synonyms]

Benzyl-PEG1-PA
BnOCH2CH2OCH2COOH
3-[2-(Benzyloxy)ethoxy]propanoic acid
Propanoic acid, 3-[2-(phenylmethoxy)ethoxy]-
[Molecular Formula]

C12H16O4
[MDL Number]

MFCD28096691
[MOL File]

91555-65-6.mol
[Molecular Weight]

224.253
Chemical PropertiesBack Directory
[Boiling point ]

195-196 °C(Press: 2 Torr)
[density ]

1.1360 g/cm3
[storage temp. ]

Storage temp. 2-8°C
[form ]

Liquid
[pka]

4.28±0.10(Predicted)
[color ]

Colorless to light yellow
[InChI]

1S/C12H16O4/c13-12(14)6-7-15-8-9-16-10-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,13,14)
[InChIKey]

SUIUDJXITUDGOR-UHFFFAOYSA-N
[SMILES]

O=C(O)CCOCCOCC1=CC=CC=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H312-H332
[Precautionary statements ]

P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

Benzyl-PEG2-acid is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].
[IC 50]

PEGs
[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]

3-[2-(Benzyloxy)ethoxy]propanoic acid(91555-65-6)1HNMR
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