Cl-C6-PEG4-O-CH2COOH
Basic information
- CAS
1799506-30-1- Standard SMILES
O=C(O)COCCOCCOCCOCCOCCCCCCCl- InChIKey
JKRQJQUHILRKGV-UHFFFAOYSA-N- Molecular formula
- C16H31ClO7
- Average molar mass
- 370.9 g/mol
Names & identifiers
- Preferred name
- Cl-C6-PEG4-O-CH2COOH
- IUPAC
- 2-[2-[2-[2-[2-(6-chlorohexoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetic acid
- English name
- PROTAC Linker 4
- Molecular formula
- C16H31ClO7
- Molecular weight
- 370.87
Names & synonyms
Cl-C6-PEG4-O-CH2COOH1799506-30-1PROTAC Linker 4MFCD3169239421-Chloro-3,6,9,12,15-pentaoxahenicosan-1-oic acid21-chloro-3,6,9,12,15-pentaoxahenicosanoic acid2-[2-[2-[2-[2-(6-chlorohexoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetic acidC16H31ClO7orb1741529AKOS037653335AT11313DA-72267
Show more names
Acetic acid, 2-[(18-chloro-3,6,9,12-tetraoxaoctadec-1-yl)oxy]-
SY529704HY-112496CS-0046142Cl-C6-PEG4-O-CH2COOH (PROTAC Linker 4)T18639F98682021-Chloro-3,6,9,12,15-pentaoxahenicosan-1-oicacid
Database identifiers
- CAS
1799506-30-1
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 83.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 20
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 267
Physicochemical properties
- Boiling point
- 484.3 · 484.3±45.0 °C(Predicted)
- Density
- 1.122 · 1.122±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Storage temp. 2-8°C
- pka
- 3.39 · 3.39±0.10(Predicted)
- form
- Oil
- color
- Colorless to light yellow
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
Chemistry & industry
Applications
UsesCl-C6-PEG4-O-CH2COOH (PROTAC Linker 4) is a PEG-based PROTAC linker can be used in the synthesis of chloroalkane-containing PROTACs (HaloPROTACs)[1].
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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