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Home > Other Heterocycles > 117254-20-3
117254-20-3 | Spiro[3,6-dioxabicyclo[3.1.0]hexane-2,4'-[1,3]dioxolane] (9CI)
CAS No: 117254-20-3 Catalog No: AG000E0E MDL No:
Product Description
Catalog Number:
AG000E0E
Chemical Name:
Spiro[3,6-dioxabicyclo[3.1.0]hexane-2,4'-[1,3]dioxolane] (9CI)
CAS Number:
117254-20-3
Molecular Formula:
C6H8O4
Molecular Weight:
144.1253
IUPAC Name:
spiro[1,3-dioxolane-4,2'-3,6-dioxabicyclo[3.1.0]hexane]
InChI:
InChI=1S/C6H8O4/c1-4-5(10-4)6(8-1)2-7-3-9-6/h4-5H,1-3H2
InChI Key:
NYEUMKAJAZNPHT-UHFFFAOYSA-N
SMILES:
O1COC2(C1)OCC1C2O1
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.042g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.126g/mol
Monoisotopic Mass:
144.042g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.2A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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