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Di-n-decyl ether

CAT: 0024-sc-268850Size: 10 gDry Ice: NoHazardous: No
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CAT#:0024-sc-268850Size:10 g
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CAS Number
2456-28-2

Chemical Information

Didecyl Ether
CAS Number2456-28-2
PubChem CID17152
IUPAC Name1-decoxydecane
Molecular FormulaC20H42O
Molecular Weight298.5
XLogP9.1
Topological Polar Surface Area9.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count18
Heavy Atom Count21
Formal Charge0
Complexity149
SMILES
CCCCCCCCCCOCCCCCCCCCC
InChI
InChI=1S/C20H42O/c1-3-5-7-9-11-13-15-17-19-21-20-18-16-14-12-10-8-6-4-2/h3-20H2,1-2H3
InChIKey
LTSWUFKUZPPYEG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Didecyl Ether
CAS: 2456-28-2
CID: 17152
Formula: C20H42O
MW: 298.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight298.5
XLogP39.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count18
Exact Mass298.323565959
Monoisotopic Mass298.323565959
Topological Polar Surface Area9.2 Ų
Heavy Atom Count21
Formal Charge0
Complexity149
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