[4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate

C130H97F16I22O53S7-7 — CID 159282416

IUPAC[4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate
SMILESCC(F)(F)COC(=O)CCCOC(=O)c1ccc(I)cc1.O=C(COC(=O)c1cc(I)cc(I)c1I)OCC(F)(F)S(=O)(=O)[O-].O=C(OC12CC3CC(C1)CC(C(=O)OCC(F)(F)S(=O)(=O)[O-])(C3)C2)c1cc(I)cc(I)c1I.O=C(OC1C=CC(C(=O)OCC(F)(F)S(=O)(=O)[O-])CC1)c1cc(I)cc(I)c1I.O=C(OC1CC2CC1CC2C(=O)OCC(F)(F)S(=O)(=O)[O-])c1cc(I)cc(I)c1I.O=C(OC1CCC(C(=O)OCC(F)(F)S(=O)(=O)[O-])CC1)c1cc(I)cc(I)c1I.O=C(OCC(F)(F)S(=O)(=O)[O-])c1ccc(OC(=O)c2cc(I)cc(I)c2I)cc1.O=C(Oc1ccc(C(=O)OCC(F)(F)S(=O)(=O)[O-])c2ccccc12)c1cc(I)cc(I)c1I
InChIInChI=1S/C20H19F2I3O7S.C20H11F2I3O7S.C17H15F2I3O7S.C16H15F2I3O7S.C16H13F2I3O7S.C16H9F2I3O7S.C14H15F2IO4.C11H7F2I3O7S/c21-20(22,33(28,29)30)9-31-17(27)18-4-10-1-11(5-18)7-19(6-10,8-18)32-16(26)13-2-12(23)3-14(24)15(13)25;21-20(22,33(28,29)30)9-31-18(26)13-5-6-16(12-4-2-1-3-11(12)13)32-19(27)14-7-10(23)8-15(24)17(14)25;18-17(19,30(25,26)27)6-28-15(23)10-2-8-1-7(10)3-13(8)29-16(24)11-4-9(20)5-12(21)14(11)22;3*17-16(18,29(24,25)26)7-27-14(22)8-1-3-10(4-2-8)28-15(23)11-5-9(19)6-12(20)13(11)21;1-14(15,16)9-21-12(18)3-2-8-20-13(19)10-4-6-11(17)7-5-10;12-11(13,24(19,20)21)4-23-8(17)3-22-10(18)6-1-5(14)2-7(15)9(6)16/h2-3,10-11H,1,4-9H2,(H,28,29,30);1-8H,9H2,(H,28,29,30);4-5,7-8,10,13H,1-3,6H2,(H,25,26,27);5-6,8,10H,1-4,7H2,(H,24,25,26);1,3,5-6,8,10H,2,4,7H2,(H,24,25,26);1-6H,7H2,(H,24,25,26);4-7H,2-3,8-9H2,1H3;1-2H,3-4H2,(H,19,20,21)/p-7
InChIKeyKZBXUYPMKITMCF-UHFFFAOYSA-G
MW5827.48 g/mol
LogP30.95
Rot. Bonds49

About [4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate

[4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate (PubChem CID 159282416) has the molecular formula C130H97F16I22O53S7-7 and a molecular weight of 5827.48 g/mol. Its IUPAC name is [4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate.

Molecular Properties

Compound Name[4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate
PubChem CID159282416
Molecular FormulaC130H97F16I22O53S7-7
Molecular Weight5827.48 g/mol
Exact Mass5825.17
IUPAC Name[4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate
SMILESCC(F)(F)COC(=O)CCCOC(=O)c1ccc(I)cc1.O=C(COC(=O)c1cc(I)cc(I)c1I)OCC(F)(F)S(=O)(=O)[O-].O=C(OC12CC3CC(C1)CC(C(=O)OCC(F)(F)S(=O)(=O)[O-])(C3)C2)c1cc(I)cc(I)c1I.O=C(OC1C=CC(C(=O)OCC(F)(F)S(=O)(=O)[O-])CC1)c1cc(I)cc(I)c1I.O=C(OC1CC2CC1CC2C(=O)OCC(F)(F)S(=O)(=O)[O-])c1cc(I)cc(I)c1I.O=C(OC1CCC(C(=O)OCC(F)(F)S(=O)(=O)[O-])CC1)c1cc(I)cc(I)c1I.O=C(OCC(F)(F)S(=O)(=O)[O-])c1ccc(OC(=O)c2cc(I)cc(I)c2I)cc1.O=C(Oc1ccc(C(=O)OCC(F)(F)S(=O)(=O)[O-])c2ccccc12)c1cc(I)cc(I)c1I
InChIInChI=1S/C20H19F2I3O7S.C20H11F2I3O7S.C17H15F2I3O7S.C16H15F2I3O7S.C16H13F2I3O7S.C16H9F2I3O7S.C14H15F2IO4.C11H7F2I3O7S/c21-20(22,33(28,29)30)9-31-17(27)18-4-10-1-11(5-18)7-19(6-10,8-18)32-16(26)13-2-12(23)3-14(24)15(13)25;21-20(22,33(28,29)30)9-31-18(26)13-5-6-16(12-4-2-1-3-11(12)13)32-19(27)14-7-10(23)8-15(24)17(14)25;18-17(19,30(25,26)27)6-28-15(23)10-2-8-1-7(10)3-13(8)29-16(24)11-4-9(20)5-12(21)14(11)22;3*17-16(18,29(24,25)26)7-27-14(22)8-1-3-10(4-2-8)28-15(23)11-5-9(19)6-12(20)13(11)21;1-14(15,16)9-21-12(18)3-2-8-20-13(19)10-4-6-11(17)7-5-10;12-11(13,24(19,20)21)4-23-8(17)3-22-10(18)6-1-5(14)2-7(15)9(6)16/h2-3,10-11H,1,4-9H2,(H,28,29,30);1-8H,9H2,(H,28,29,30);4-5,7-8,10,13H,1-3,6H2,(H,25,26,27);5-6,8,10H,1-4,7H2,(H,24,25,26);1,3,5-6,8,10H,2,4,7H2,(H,24,25,26);1-6H,7H2,(H,24,25,26);4-7H,2-3,8-9H2,1H3;1-2H,3-4H2,(H,19,20,21)/p-7
InChIKeyKZBXUYPMKITMCF-UHFFFAOYSA-G
XLogP30.95
TPSA821.20 Ų
H-Bond Donors
H-Bond Acceptors53
Rotatable Bonds49
Heavy Atoms228
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005827.48
LogP ≤ 530.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1053

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze [4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate with MolForge

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Frequently Asked Questions

What is the IUPAC name of [4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate?
The IUPAC name of [4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate (CID 159282416) is [4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate.
What is the SMILES notation for [4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate?
The canonical SMILES for [4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate is CC(F)(F)COC(=O)CCCOC(=O)c1ccc(I)cc1.O=C(COC(=O)c1cc(I)cc(I)c1I)OCC(F)(F)S(=O)(=O)[O-].O=C(OC12CC3CC(C1)CC(C(=O)OCC(F)(F)S(=O)(=O)[O-])(C3)C2)c1cc(I)cc(I)c1I.O=C(OC1C=CC(C(=O)OCC(F)(F)S(=O)(=O)[O-])CC1)c1cc(I)cc(I)c1I.O=C(OC1CC2CC1CC2C(=O)OCC(F)(F)S(=O)(=O)[O-])c1cc(I)cc(I)c1I.O=C(OC1CCC(C(=O)OCC(F)(F)S(=O)(=O)[O-])CC1)c1cc(I)cc(I)c1I.O=C(OCC(F)(F)S(=O)(=O)[O-])c1ccc(OC(=O)c2cc(I)cc(I)c2I)cc1.O=C(Oc1ccc(C(=O)OCC(F)(F)S(=O)(=O)[O-])c2ccccc12)c1cc(I)cc(I)c1I.
What is the InChIKey of [4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate?
The InChIKey is KZBXUYPMKITMCF-UHFFFAOYSA-G. The full InChI is InChI=1S/C20H19F2I3O7S.C20H11F2I3O7S.C17H15F2I3O7S.C16H15F2I3O7S.C16H13F2I3O7S.C16H9F2I3O7S.C14H15F2IO4.C11H7F2I3O7S/c21-20(22,33(28,29)30)9-31-17(27)18-4-10-1-11(5-18)7-19(6-10,8-18)32-16(26)13-2-12(23)3-14(24)15(13)25;21-20(22,33(28,29)30)9-31-18(26)13-5-6-16(12-4-2-1-3-11(12)13)32-19(27)14-7-10(23)8-15(24)17(14)25;18-17(19,30(25,26)27)6-28-15(23)10-2-8-1-7(10)3-13(8)29-16(24)11-4-9(20)5-12(21)14(11)22;3*17-16(18,29(24,25)26)7-27-14(22)8-1-3-10(4-2-8)28-15(23)11-5-9(19)6-12(20)13(11)21;1-14(15,16)9-21-12(18)3-2-8-20-13(19)10-4-6-11(17)7-5-10;12-11(13,24(19,20)21)4-23-8(17)3-22-10(18)6-1-5(14)2-7(15)9(6)16/h2-3,10-11H,1,4-9H2,(H,28,29,30);1-8H,9H2,(H,28,29,30);4-5,7-8,10,13H,1-3,6H2,(H,25,26,27);5-6,8,10H,1-4,7H2,(H,24,25,26);1,3,5-6,8,10H,2,4,7H2,(H,24,25,26);1-6H,7H2,(H,24,25,26);4-7H,2-3,8-9H2,1H3;1-2H,3-4H2,(H,19,20,21)/p-7.
What are the key properties of [4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate?
[4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate has a molecular weight of 5827.48 g/mol, XLogP of 30.95, 49 rotatable bonds, 0 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,2-difluoropropoxy)-4-oxobutyl] 4-iodobenzoate;1,1-difluoro-2-[2-(2,3,5-triiodobenzoyl)oxyacetyl]oxyethanesulfonate;1,1-difluoro-2-[3-(2,3,5-triiodobenzoyl)oxyadamantane-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxybenzoyl]oxyethanesulfonate;1,1-difluoro-2-[5-(2,3,5-triiodobenzoyl)oxybicyclo[2.2.1]heptane-2-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohexanecarbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxycyclohex-2-ene-1-carbonyl]oxyethanesulfonate;1,1-difluoro-2-[4-(2,3,5-triiodobenzoyl)oxynaphthalene-1-carbonyl]oxyethanesulfonate is sourced from PubChem (CID 159282416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).