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M-PEG12-alcohol

CAT: 0127-BIPG1567-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-BIPG1567-01Size:100 mg
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CAS Number
2050595-03-2
MDL Number
MFCD06797088
Purity
95%
Smiles
COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO

Chemical Information

Dodecaethylene Glycol Monomethyl Ether
CAS Number2050595-03-2
PubChem CID14550548
IUPAC Name2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
Molecular FormulaC25H52O13
Molecular Weight560.7
XLogP-2.2
Topological Polar Surface Area131
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count13
Rotatable Bond Count35
Heavy Atom Count38
Formal Charge0
Complexity407
SMILES
COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
InChI
InChI=1S/C25H52O13/c1-27-4-5-29-8-9-31-12-13-33-16-17-35-20-21-37-24-25-38-23-22-36-19-18-34-15-14-32-11-10-30-7-6-28-3-2-26/h26H,2-25H2,1H3
InChIKey
PLQZJIIDLZRWBG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dodecaethylene Glycol Monomethyl Ether
CAS: 2050595-03-2
CID: 14550548
Formula: C25H52O13
MW: 560.7
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight560.7
XLogP3-2.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count13
Rotatable Bond Count35
Exact Mass560.34079171
Monoisotopic Mass560.34079171
Topological Polar Surface Area131 Ų
Heavy Atom Count38
Formal Charge0
Complexity407
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