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PEG (n=18)

CAT: 1596-AR-E02072-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-E02072-02Size:25 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
4445-03-8
Synonyms
3,6,9,12,15,18,21,24,27,30,33,36,39,42,45,48,51-Heptadecaoxatripentacontane-1,53-diol
Molecular Formula
C36H74O19
Molecular Weight
810.97
API Name
Ethylene Glycol

Chemical Information

HO-Peg18-OH
CAS Number4445-03-8
PubChem CID14497137
IUPAC Name2-[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]ethanol
Molecular FormulaC36H74O19
Molecular Weight811.0
XLogP-3.7
Topological Polar Surface Area197
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count19
Rotatable Bond Count52
Heavy Atom Count55
Formal Charge0
Complexity606
SMILES
C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O
InChI
InChI=1S/C36H74O19/c37-1-3-39-5-7-41-9-11-43-13-15-45-17-19-47-21-23-49-25-27-51-29-31-53-33-35-55-36-34-54-32-30-52-28-26-50-24-22-48-20-18-46-16-14-44-12-10-42-8-6-40-4-2-38/h37-38H,1-36H2
InChIKey
WPTOGBNHVWOHQK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of HO-Peg18-OH
CAS: 4445-03-8
CID: 14497137
Formula: C36H74O19
MW: 811.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight811.0
XLogP3-3.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count19
Rotatable Bond Count52
Exact Mass810.48243013
Monoisotopic Mass810.48243013
Topological Polar Surface Area197 Ų
Heavy Atom Count55
Formal Charge0
Complexity606
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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