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Vinylene carbonate

CAT: 0024-sc-251428ASize: 25 gDry Ice: NoHazardous: No
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CAT#:0024-sc-251428ASize:25 g
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CAS Number
872-36-6

Chemical Information

Vinylene carbonate
CAS Number872-36-6
PubChem CID13385
IUPAC Name1,3-dioxol-2-one
Molecular FormulaC3H2O3
Molecular Weight86.05
XLogP0.3
Topological Polar Surface Area35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count6
Formal Charge0
Complexity84
SMILES
C1=COC(=O)O1
InChI
InChI=1S/C3H2O3/c4-3-5-1-2-6-3/h1-2H
InChIKey
VAYTZRYEBVHVLE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Vinylene carbonate
CAS: 872-36-6
CID: 13385
Formula: C3H2O3
MW: 86.05
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight86.05
XLogP30.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass86.000393922
Monoisotopic Mass86.000393922
Topological Polar Surface Area35.5 Ų
Heavy Atom Count6
Formal Charge0
Complexity84.2
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