Free Chemical Databases
-
[Synonyms]
NSC611914
[Structure]
[ Properties Computed from Structure]
Molecular Weight 262.25642 [g/mol] Molecular Formula C11H18O7 XLogP -0.8 H-Bond Donor 2 H-Bond Acceptor 7 Rotatable Bond Count 4 Exact Mass 262.105253 MonoIsotopic Mass 262.105253 Topological Polar Surface Area 94.5 Heavy Atom Count 18 Formal Charge 0 Complexity 329 Isotope Atom Count 0 Defined Atom StereoCenter Count 0 Undefined Atom StereoCenter Count 5 Defined Bond StereoCenter Count 0 Undefined Bond StereoCenter Count 0 Covalently-Bonded Unit Count 1
[ Descriptors Computed from Structure]
IUPAC Name: [5-(1,2-dihydroxyethyl)-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[4,5-d][1,
3]dioxol-6-yl] acetate
Canonical SMILES: CC(=O)OC1C2C(OC1C(CO)O)OC(O2)(C)C
InChI: InChI=1/C11H18O7/c1-5(13)15-8-7(6(14)4-12)16-10-9(8)17-11(2,
3)18-10/h6-10,12,14H,4H2,1-3H3
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