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M-PEG3-Boc

CAT: 0931-T15854-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T15854-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1778219-81-0
Target
PROTAC Linker, Others
Related Pathways
Others, PROTAC
Bioactivity
M-PEG3-Boc is a PROTAC linker derived from PEG and alkyl/ether, utilized in the synthesis of PROTACs[1].
Smiles
O=C(OC(C)(C)C)CCOCCOCCOC
Molecular Formula
C12H24O5
Molecular Weight
248.32
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

m-PEG3-Boc
CAS Number1778219-81-0
PubChem CID57890910
IUPAC Nametert-butyl 3-[2-(2-methoxyethoxy)ethoxy]propanoate
Molecular FormulaC12H24O5
Molecular Weight248.32
XLogP0.6
Topological Polar Surface Area54
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Heavy Atom Count17
Formal Charge0
Complexity198
SMILES
CC(C)(C)OC(=O)CCOCCOCCOC
InChI
InChI=1S/C12H24O5/c1-12(2,3)17-11(13)5-6-15-9-10-16-8-7-14-4/h5-10H2,1-4H3
InChIKey
CTECCIYKQSINBP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of m-PEG3-Boc
CAS: 1778219-81-0
CID: 57890910
Formula: C12H24O5
MW: 248.32
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight248.32
XLogP30.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Exact Mass248.16237386
Monoisotopic Mass248.16237386
Topological Polar Surface Area54 Ų
Heavy Atom Count17
Formal Charge0
Complexity198
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes