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Boc-aminooxy-PEG2-propargyl

CAT: 0931-T14740-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0931-T14740-01Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1895922-74-3
Target
Others, PROTAC Linker
Related Pathways
PROTAC, Others
Bioactivity
Boc-NH-PEG2-propargyl is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].
Smiles
O=C(OC(C)(C)C)NOCCOCCOCC#C
Molecular Formula
C12H21NO5
Molecular Weight
259.3
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

t-Boc-aminooxy-PEG2-Propargyl
CAS Number1895922-74-3
PubChem CID119058289
IUPAC Nametert-butyl N-[2-(2-prop-2-ynoxyethoxy)ethoxy]carbamate
Molecular FormulaC12H21NO5
Molecular Weight259.30
XLogP0.8
Topological Polar Surface Area66
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Heavy Atom Count18
Formal Charge0
Complexity276
SMILES
CC(C)(C)OC(=O)NOCCOCCOCC#C
InChI
InChI=1S/C12H21NO5/c1-5-6-15-7-8-16-9-10-17-13-11(14)18-12(2,3)4/h1H,6-10H2,2-4H3,(H,13,14)
InChIKey
XXPUFYWATPLMHN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of t-Boc-aminooxy-PEG2-Propargyl
CAS: 1895922-74-3
CID: 119058289
Formula: C12H21NO5
MW: 259.30
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight259.30
XLogP30.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Exact Mass259.14197277
Monoisotopic Mass259.14197277
Topological Polar Surface Area66 Ų
Heavy Atom Count18
Formal Charge0
Complexity276
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