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2,2′-Furoin

CAT: 1489-F7650-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:1489-F7650-01Size:5 g
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CAS Number
552-86-3

Chemical Information

Furoin
CAS Number552-86-3
PubChem CID11100
IUPAC Name1,2-bis(furan-2-yl)-2-hydroxyethanone
Molecular FormulaC10H8O4
Molecular Weight192.17
XLogP0.5
Topological Polar Surface Area63.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count14
Formal Charge0
Complexity216
SMILES
C1=COC(=C1)C(C(=O)C2=CC=CO2)O
InChI
InChI=1S/C10H8O4/c11-9(7-3-1-5-13-7)10(12)8-4-2-6-14-8/h1-6,9,11H
InChIKey
MIJRFWVFNKQQDK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Furoin
CAS: 552-86-3
CID: 11100
Formula: C10H8O4
MW: 192.17
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight192.17
XLogP30.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass192.04225873
Monoisotopic Mass192.04225873
Topological Polar Surface Area63.6 Ų
Heavy Atom Count14
Formal Charge0
Complexity216
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes