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Hydroxy-PEG12-t-butyl ester

CAT: 0127-BIPG1456-01Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0127-BIPG1456-01Size:500 mg
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CAS Number
1186025-29-5
MDL Number
MFCD06201003
Smiles
CC(C)(C)OC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO

Chemical Information

Hydroxy-PEG24-t-butyl ester
CAS Number1186025-29-5
PubChem CID51341047
IUPAC Nametert-butyl 3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate
Molecular FormulaC55H110O27
Molecular Weight1203.4
XLogP-3.2
Topological Polar Surface Area268
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count27
Rotatable Bond Count76
Heavy Atom Count82
Formal Charge0
Complexity1170
SMILES
CC(C)(C)OC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
InChI
InChI=1S/C55H110O27/c1-55(2,3)82-54(57)4-6-58-8-10-60-12-14-62-16-18-64-20-22-66-24-26-68-28-30-70-32-34-72-36-38-74-40-42-76-44-46-78-48-50-80-52-53-81-51-49-79-47-45-77-43-41-75-39-37-73-35-33-71-31-29-69-27-25-67-23-21-65-19-17-63-15-13-61-11-9-59-7-5-56/h56H,4-53H2,1-3H3
InChIKey
YMILISGQCISYOH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hydroxy-PEG24-t-butyl ester
CAS: 1186025-29-5
CID: 51341047
Formula: C55H110O27
MW: 1203.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1203.4
XLogP3-3.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count27
Rotatable Bond Count76
Exact Mass1202.72344823
Monoisotopic Mass1202.72344823
Topological Polar Surface Area268 Ų
Heavy Atom Count82
Formal Charge0
Complexity1170
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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Alternative Products

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HY-130159Hydroxy-PEG12-t-butyl ester
HY-W190751BBis-PEG12-t-butyl ester
572578m-PEG12-t-butyl ester
HY-172505Mal-PEG12-t-butyl ester
GTR19267032-01Methyltetrazine-PEG12-t-butyl ester
572774Azido-PEG12-t-butyl ester
HY-143837Acid-PEG12-t-butyl ester
HY-132117Bromo-PEG12-t-butyl ester
T23729-01Amino-PEG12-t-butyl ester

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