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PEG6- (CH2CO2t-Butyl) 2

CAT: 0127-BIPG2647-01Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0127-BIPG2647-01Size:500 mg
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CAS Number
211746-79-1
Purity
98%
Smiles
CC (C) (C) OC (=O) COCCOCCOCCOCCOCCOCC (=O) OC (C) (C) C

Chemical Information

PEG6-(CH2CO2t-Butyl)2
CAS Number211746-79-1
PubChem CID10837936
IUPAC Nametert-butyl 2-[2-[2-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetate
Molecular FormulaC22H42O10
Molecular Weight466.6
XLogP1.2
Topological Polar Surface Area108
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count23
Heavy Atom Count32
Formal Charge0
Complexity438
SMILES
CC(C)(C)OC(=O)COCCOCCOCCOCCOCCOCC(=O)OC(C)(C)C
InChI
InChI=1S/C22H42O10/c1-21(2,3)31-19(23)17-29-15-13-27-11-9-25-7-8-26-10-12-28-14-16-30-18-20(24)32-22(4,5)6/h7-18H2,1-6H3
InChIKey
SHLKHLOTTZARIZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of PEG6-(CH2CO2t-Butyl)2
CAS: 211746-79-1
CID: 10837936
Formula: C22H42O10
MW: 466.6
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight466.6
XLogP31.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count23
Exact Mass466.27779753
Monoisotopic Mass466.27779753
Topological Polar Surface Area108 Ų
Heavy Atom Count32
Formal Charge0
Complexity438
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