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2-[2- (2-Propynyloxy) ethoxy]ethanol

CAT: 0024-sc-476547Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-476547Size:1 g
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CAS Number
7218-43-1

Chemical Information

2-(2-(Propyn-2-yloxy)ethoxy)ethanol
CAS Number7218-43-1
PubChem CID81639
IUPAC Name2-(2-prop-2-ynoxyethoxy)ethanol
Molecular FormulaC7H12O3
Molecular Weight144.17
XLogP-0.6
Topological Polar Surface Area38.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count10
Formal Charge0
Complexity103
SMILES
C#CCOCCOCCO
InChI
InChI=1S/C7H12O3/c1-2-4-9-6-7-10-5-3-8/h1,8H,3-7H2
InChIKey
HUSDTFBXUYBZJD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(2-(Propyn-2-yloxy)ethoxy)ethanol
CAS: 7218-43-1
CID: 81639
Formula: C7H12O3
MW: 144.17
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight144.17
XLogP3-0.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass144.078644241
Monoisotopic Mass144.078644241
Topological Polar Surface Area38.7 Ų
Heavy Atom Count10
Formal Charge0
Complexity103
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