2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane

C116H190F10O13 — CID 159972387

About 2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane

2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane (PubChem CID 159972387) has the molecular formula C116H190F10O13 and a molecular weight of 1982.76 g/mol. Its IUPAC name is 2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane.

Molecular Properties

• Compound Name: 2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane
• PubChem CID: 159972387
• Molecular Formula: C116H190F10O13
• Molecular Weight: 1982.76 g/mol
• Exact Mass: 1981.40
• IUPAC Name: 2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane
• SMILES: CCC/C=C/C1CCC(C2COC(C3COC(CC=C(F)F)OC3)OC2)CC1.CCCC1CCC(C2COC(C3COC(C=C(F)F)OC3)OC2)CC1.CCCC1CCC(CCC2CCC(C3COC(C=C(F)F)OC3)CC2)CC1.CCCCCCCC1CCC(C2CCC(C3CCC(CC=C(F)F)CO3)CC2)CC1.CCCOC1CCC(C2CCC(C3CCC(CCCC=C(F)F)CO3)CC2)CC1
• InChI: InChI=1S/C27H46F2O.C25H42F2O2.C23H38F2O2.C22H34F2O4.C19H30F2O4/c1-2-3-4-5-6-7-21-8-12-23(13-9-21)24-14-16-25(17-15-24)26-18-10-22(20-30-26)11-19-27(28)29;1-2-17-28-23-14-12-21(13-15-23)20-8-10-22(11-9-20)24-16-7-19(18-29-24)5-3-4-6-25(26)27;1-2-3-17-4-6-18(7-5-17)8-9-19-10-12-20(13-11-19)21-15-26-23(27-16-21)14-22(24)25;1-2-3-4-5-16-6-8-17(9-7-16)18-12-27-22(28-13-18)19-14-25-21(26-15-19)11-10-20(23)24;1-2-3-13-4-6-14(7-5-13)15-9-24-19(25-10-15)16-11-22-18(23-12-16)8-17(20)21/h19,21-26H,2-18,20H2,1H3;6,19-24H,2-5,7-18H2,1H3;14,17-21,23H,2-13,15-16H2,1H3;4-5,10,16-19,21-22H,2-3,6-9,11-15H2,1H3;8,13-16,18-19H,2-7,9-12H2,1H3/b;;;5-4+
• InChIKey: OESHDWQNYNEWHS-LXDGTOLWSA-N
• XLogP: 33.05
• TPSA: 119.99 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 38
• Heavy Atoms: 139
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1982.76
LogP ≤ 5	33.05
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane?

The IUPAC name of 2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane (CID 159972387) is 2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane.

What is the SMILES notation for 2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane?

The canonical SMILES for 2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane is CCC/C=C/C1CCC(C2COC(C3COC(CC=C(F)F)OC3)OC2)CC1.CCCC1CCC(C2COC(C3COC(C=C(F)F)OC3)OC2)CC1.CCCC1CCC(CCC2CCC(C3COC(C=C(F)F)OC3)CC2)CC1.CCCCCCCC1CCC(C2CCC(C3CCC(CC=C(F)F)CO3)CC2)CC1.CCCOC1CCC(C2CCC(C3CCC(CCCC=C(F)F)CO3)CC2)CC1.

What is the InChIKey of 2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane?

The InChIKey is OESHDWQNYNEWHS-LXDGTOLWSA-N. The full InChI is InChI=1S/C27H46F2O.C25H42F2O2.C23H38F2O2.C22H34F2O4.C19H30F2O4/c1-2-3-4-5-6-7-21-8-12-23(13-9-21)24-14-16-25(17-15-24)26-18-10-22(20-30-26)11-19-27(28)29;1-2-17-28-23-14-12-21(13-15-23)20-8-10-22(11-9-20)24-16-7-19(18-29-24)5-3-4-6-25(26)27;1-2-3-17-4-6-18(7-5-17)8-9-19-10-12-20(13-11-19)21-15-26-23(27-16-21)14-22(24)25;1-2-3-4-5-16-6-8-17(9-7-16)18-12-27-22(28-13-18)19-14-25-21(26-15-19)11-10-20(23)24;1-2-3-13-4-6-14(7-5-13)15-9-24-19(25-10-15)16-11-22-18(23-12-16)8-17(20)21/h19,21-26H,2-18,20H2,1H3;6,19-24H,2-5,7-18H2,1H3;14,17-21,23H,2-13,15-16H2,1H3;4-5,10,16-19,21-22H,2-3,6-9,11-15H2,1H3;8,13-16,18-19H,2-7,9-12H2,1H3/b;;;5-4+;.

What are the key properties of 2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane?

2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane has a molecular weight of 1982.76 g/mol, XLogP of 33.05, 38 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2,2-difluoroethenyl)-5-[5-(4-propylcyclohexyl)-1,3-dioxan-2-yl]-1,3-dioxane;2-(2,2-difluoroethenyl)-5-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]-1,3-dioxane;5-(5,5-difluoropent-4-enyl)-2-[4-(4-propoxycyclohexyl)cyclohexyl]oxane;5-(3,3-difluoroprop-2-enyl)-2-[4-(4-heptylcyclohexyl)cyclohexyl]oxane;2-(3,3-difluoroprop-2-enyl)-5-[5-[4-[(E)-pent-1-enyl]cyclohexyl]-1,3-dioxan-2-yl]-1,3-dioxane is sourced from PubChem (CID 159972387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).