(4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate

C103H128F24O51 — CID 161365544

About (4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate

(4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate (PubChem CID 161365544) has the molecular formula C103H128F24O51 and a molecular weight of 2638.06 g/mol. Its IUPAC name is (4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate.

Molecular Properties

• Compound Name: (4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate
• PubChem CID: 161365544
• Molecular Formula: C103H128F24O51
• Molecular Weight: 2638.06 g/mol
• Exact Mass: 2636.70
• IUPAC Name: (4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate
• SMILES: CC(C)(C(=O)OC1CCOC1=O)C(F)(F)F.CC(C)(F)C(=O)OC1CCOC1=O.CC(F)(F)C(=O)OC1(C)CCCOC1=O.CC(F)(F)C(=O)OC1C(=O)OC(=O)C1O.CC(F)(F)C(=O)OC1C(=O)OCC1O.CC(F)(F)C(=O)OC1CCC2CC1(C)OC2=O.CC(F)(F)C(=O)OC1CCC2CC1OC2=O.CC(F)(F)C(=O)OC1CCCCOC1=O.CC(F)(F)C(=O)OC1CCCOC1=O.CC(F)(F)C(=O)OCC1CCC(=O)O1.CC1CCC(OC(=O)C(C)(F)F)C(=O)O1.CC1OC(=O)CC1OC(=O)C(C)(F)F
• InChI: InChI=1S/C11H14F2O4.C10H12F2O4.C9H11F3O4.3C9H12F2O4.3C8H10F2O4.C8H11FO4.C7H6F2O6.C7H8F2O5/c1-10-5-6(8(14)17-10)3-4-7(10)16-9(15)11(2,12)13;1-10(11,12)9(14)16-6-3-2-5-4-7(6)15-8(5)13;1-8(2,9(10,11)12)7(14)16-5-3-4-15-6(5)13;1-8(4-3-5-14-6(8)12)15-7(13)9(2,10)11;1-5-3-4-6(7(12)14-5)15-8(13)9(2,10)11;1-9(10,11)8(13)15-6-4-2-3-5-14-7(6)12;1-4-5(3-6(11)13-4)14-7(12)8(2,9)10;1-8(9,10)7(12)13-4-5-2-3-6(11)14-5;1-8(9,10)7(12)14-5-3-2-4-13-6(5)11;1-8(2,9)7(11)13-5-3-4-12-6(5)10;1-7(8,9)6(13)14-3-2(10)4(11)15-5(3)12;1-7(8,9)6(12)14-4-3(10)2-13-5(4)11/h6-7H,3-5H2,1-2H3;5-7H,2-4H2,1H3;5H,3-4H2,1-2H3;3-5H2,1-2H3;5-6H,3-4H2,1-2H3;6H,2-5H2,1H3;4-5H,3H2,1-2H3;2*5H,2-4H2,1H3;5H,3-4H2,1-2H3;2-3,10H,1H3;3-4,10H,2H2,1H3
• InChIKey: VPTLMKQPGSCZST-UHFFFAOYSA-N
• XLogP: 9.95
• TPSA: 688.73 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 51
• Rotatable Bonds: 25
• Heavy Atoms: 178
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2638.06
LogP ≤ 5	9.95
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	51

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate?

The IUPAC name of (4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate (CID 161365544) is (4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate.

What is the SMILES notation for (4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate?

The canonical SMILES for (4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate is CC(C)(C(=O)OC1CCOC1=O)C(F)(F)F.CC(C)(F)C(=O)OC1CCOC1=O.CC(F)(F)C(=O)OC1(C)CCCOC1=O.CC(F)(F)C(=O)OC1C(=O)OC(=O)C1O.CC(F)(F)C(=O)OC1C(=O)OCC1O.CC(F)(F)C(=O)OC1CCC2CC1(C)OC2=O.CC(F)(F)C(=O)OC1CCC2CC1OC2=O.CC(F)(F)C(=O)OC1CCCCOC1=O.CC(F)(F)C(=O)OC1CCCOC1=O.CC(F)(F)C(=O)OCC1CCC(=O)O1.CC1CCC(OC(=O)C(C)(F)F)C(=O)O1.CC1OC(=O)CC1OC(=O)C(C)(F)F.

What is the InChIKey of (4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate?

The InChIKey is VPTLMKQPGSCZST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2O4.C10H12F2O4.C9H11F3O4.3C9H12F2O4.3C8H10F2O4.C8H11FO4.C7H6F2O6.C7H8F2O5/c1-10-5-6(8(14)17-10)3-4-7(10)16-9(15)11(2,12)13;1-10(11,12)9(14)16-6-3-2-5-4-7(6)15-8(5)13;1-8(2,9(10,11)12)7(14)16-5-3-4-15-6(5)13;1-8(4-3-5-14-6(8)12)15-7(13)9(2,10)11;1-5-3-4-6(7(12)14-5)15-8(13)9(2,10)11;1-9(10,11)8(13)15-6-4-2-3-5-14-7(6)12;1-4-5(3-6(11)13-4)14-7(12)8(2,9)10;1-8(9,10)7(12)13-4-5-2-3-6(11)14-5;1-8(9,10)7(12)14-5-3-2-4-13-6(5)11;1-8(2,9)7(11)13-5-3-4-12-6(5)10;1-7(8,9)6(13)14-3-2(10)4(11)15-5(3)12;1-7(8,9)6(12)14-4-3(10)2-13-5(4)11/h6-7H,3-5H2,1-2H3;5-7H,2-4H2,1H3;5H,3-4H2,1-2H3;3-5H2,1-2H3;5-6H,3-4H2,1-2H3;6H,2-5H2,1H3;4-5H,3H2,1-2H3;2*5H,2-4H2,1H3;5H,3-4H2,1-2H3;2-3,10H,1H3;3-4,10H,2H2,1H3.

What are the key properties of (4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate?

(4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate has a molecular weight of 2638.06 g/mol, XLogP of 9.95, 25 rotatable bonds, 2 hydrogen bond donors, and 51 hydrogen bond acceptors.

Where does this data come from?

All data for (4-hydroxy-2,5-dioxooxolan-3-yl) 2,2-difluoropropanoate;(4-hydroxy-2-oxooxolan-3-yl) 2,2-difluoropropanoate;(5-methyl-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(3-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(6-methyl-2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-methyl-5-oxooxolan-3-yl) 2,2-difluoropropanoate;(7-oxo-6-oxabicyclo[3.2.1]octan-4-yl) 2,2-difluoropropanoate;(2-oxooxan-3-yl) 2,2-difluoropropanoate;(2-oxooxepan-3-yl) 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 2-fluoro-2-methylpropanoate;(5-oxooxolan-2-yl)methyl 2,2-difluoropropanoate;(2-oxooxolan-3-yl) 3,3,3-trifluoro-2,2-dimethylpropanoate is sourced from PubChem (CID 161365544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).