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Propargyl-PEG2-β-D-glucose

CAT: 0926-DUD40973-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0926-DUD40973-01Size:5 g
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CAS Number
2353409-73-9
Molecular Formula
C13H22O8
Molecular Weight
306.31 g/mol
Controlled
No

Chemical Information

Propargyl-PEG2-beta-D-glucose
CAS Number2353409-73-9
PubChem CID146025995
IUPAC Name(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[2-(2-prop-2-ynoxyethoxy)ethoxy]oxane-3,4,5-triol
Molecular FormulaC13H22O8
Molecular Weight306.31
XLogP-2.2
Topological Polar Surface Area118
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Heavy Atom Count21
Formal Charge0
Complexity327
SMILES
C#CCOCCOCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
InChI
InChI=1S/C13H22O8/c1-2-3-18-4-5-19-6-7-20-13-12(17)11(16)10(15)9(8-14)21-13/h1,9-17H,3-8H2/t9-,10-,11+,12-,13-/m1/s1
InChIKey
VCAWUMOFEKQAES-UJPOAAIJSA-N
Chemical Structure
2D Structure
2D structure of Propargyl-PEG2-beta-D-glucose
CAS: 2353409-73-9
CID: 146025995
Formula: C13H22O8
MW: 306.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight306.31
XLogP3-2.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Exact Mass306.13146766
Monoisotopic Mass306.13146766
Topological Polar Surface Area118 Ų
Heavy Atom Count21
Formal Charge0
Complexity327
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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