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[(2R,3R,4R)-3-(benzoyloxy)-4-fluoro-4-methyl-5-oxooxolan-2-yl]methyl benzoate

[(2R,3R,4R)-3-(benzoyloxy)-4-fluoro-4-methyl-5-oxooxolan-2-yl]methyl benzoate

CAS: 874638-80-9

Formula: C20H17FO6

SMILES: C[C@@]1(F)[C@H](OC(=O)C2=CC=CC=C2)[C@@H](COC(=O)C2=CC=CC=C2)OC1=O

IUPAC: [(2R,3R,4R)-3-(benzoyloxy)-4-fluoro-4-methyl-5-oxooxolan-2-yl]methyl benzoate

InChI: InChI=1S/C20H17FO6/c1-20(21)16(27-18(23)14-10-6-3-7-11-14)15(26-19(20)24)12-25-17(22)13-8-4-2-5-9-13/h2-11,15-16H,12H2,1H3/t15-,16-,20-/m1/s1

Composition: C (64.51%), H (4.60%), F (5.10%), O (25.78%)

Molar Mass: 372.348

Atom Count: 44

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 3
Exact Mass 372.10091643
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey OUKYMZJNLWKCSO-JXXFODFXSA-N
Lipinski's Rule of Five 1
Molar Refractivity 91.48
Topological Polar Surface Area 78.9
Polarizability 35.96
Ring Count 3
Rotatable Bond Count 7

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