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Cbz-NH-PEG-alkyne

CAT: 0013-GTR19276375-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19276375-01Size:10 mg
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Description
Cbz-NH-PEG-alkyne is a PROTAC linker utilized in the synthesis of PROTAC molecules.
CAS Number
2680859-66-7
Smiles
O=C (OCC=1C=CC=CC1) NCCOCC#C
Molecular Formula
C13H15NO3
Molecular Weight
233.27
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

benzyl N-[2-(prop-2-yn-1-yloxy)ethyl]carbamate
CAS Number2680859-66-7
PubChem CID165912199
IUPAC Namebenzyl N-(2-prop-2-ynoxyethyl)carbamate
Molecular FormulaC13H15NO3
Molecular Weight233.26
XLogP1.4
Topological Polar Surface Area47.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Heavy Atom Count17
Formal Charge0
Complexity263
SMILES
C#CCOCCNC(=O)OCC1=CC=CC=C1
InChI
InChI=1S/C13H15NO3/c1-2-9-16-10-8-14-13(15)17-11-12-6-4-3-5-7-12/h1,3-7H,8-11H2,(H,14,15)
InChIKey
SGGFTFZWTYQDPA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of benzyl N-[2-(prop-2-yn-1-yloxy)ethyl]carbamate
CAS: 2680859-66-7
CID: 165912199
Formula: C13H15NO3
MW: 233.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight233.26
XLogP31.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count7
Exact Mass233.10519334
Monoisotopic Mass233.10519334
Topological Polar Surface Area47.6 Ų
Heavy Atom Count17
Formal Charge0
Complexity263
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

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