C344H456F24O60 — CID 160861224
[4-[difluoro-[6-(2-methylprop-2-enoyloxymethyl)naphthalen-2-yl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[4-[difluoro-[4-(2-methylprop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-(2-methylprop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-[4-(prop-2-enoyloxymethyl)cyclohexyl]cyclohexyl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-(prop-2-enoyloxymethyl)cyclohexyl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[6-(prop-2-enoyloxymethyl)naphthalen-2-yl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[6-(prop-2-enoyloxymethyl)naphthalen-2-yl]methoxy]phenyl]methyl prop-2-enoate;[4-[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]cyclohexyl]methyl prop-2-enoate;[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]methyl prop-2-enoate;[6-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]naphthalen-2-yl]methyl 2-methylprop-2-enoate;ethane (PubChem CID 160861224) has the molecular formula C344H456F24O60 and a molecular weight of 6007.32 g/mol. Its IUPAC name is [4-[difluoro-[6-(2-methylprop-2-enoyloxymethyl)naphthalen-2-yl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[4-[difluoro-[4-(2-methylprop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-(2-methylprop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-[4-(prop-2-enoyloxymethyl)cyclohexyl]cyclohexyl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-(prop-2-enoyloxymethyl)cyclohexyl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[6-(prop-2-enoyloxymethyl)naphthalen-2-yl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[6-(prop-2-enoyloxymethyl)naphthalen-2-yl]methoxy]phenyl]methyl prop-2-enoate;[4-[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]cyclohexyl]methyl prop-2-enoate;[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]methyl prop-2-enoate;[6-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]naphthalen-2-yl]methyl 2-methylprop-2-enoate;ethane.
| Compound Name | [4-[difluoro-[6-(2-methylprop-2-enoyloxymethyl)naphthalen-2-yl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[4-[difluoro-[4-(2-methylprop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-(2-methylprop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-[4-(prop-2-enoyloxymethyl)cyclohexyl]cyclohexyl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-(prop-2-enoyloxymethyl)cyclohexyl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[6-(prop-2-enoyloxymethyl)naphthalen-2-yl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[6-(prop-2-enoyloxymethyl)naphthalen-2-yl]methoxy]phenyl]methyl prop-2-enoate;[4-[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]cyclohexyl]methyl prop-2-enoate;[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]methyl prop-2-enoate;[6-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]naphthalen-2-yl]methyl 2-methylprop-2-enoate;ethane |
|---|---|
| PubChem CID | 160861224 |
| Molecular Formula | C344H456F24O60 |
| Molecular Weight | 6007.32 g/mol |
| Exact Mass | 6003.22 |
| IUPAC Name | [4-[difluoro-[6-(2-methylprop-2-enoyloxymethyl)naphthalen-2-yl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[4-[difluoro-[4-(2-methylprop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-(2-methylprop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-[4-(prop-2-enoyloxymethyl)cyclohexyl]cyclohexyl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-(prop-2-enoyloxymethyl)cyclohexyl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[6-(prop-2-enoyloxymethyl)naphthalen-2-yl]methoxy]phenyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[6-(prop-2-enoyloxymethyl)naphthalen-2-yl]methoxy]phenyl]methyl prop-2-enoate;[4-[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]cyclohexyl]methyl prop-2-enoate;[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]methyl 2-methylprop-2-enoate;[4-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]cyclohexyl]methyl prop-2-enoate;[6-[difluoro-[4-(prop-2-enoyloxymethyl)phenoxy]methyl]naphthalen-2-yl]methyl 2-methylprop-2-enoate;ethane |
| SMILES | C=C(C)C(=O)OCc1ccc(OC(F)(F)C2CCC(C3CCC(COC(=O)C(=C)C)CC3)CC2)cc1.C=C(C)C(=O)OCc1ccc(OC(F)(F)C2CCC(COC(=O)C(=C)C)CC2)cc1.C=C(C)C(=O)OCc1ccc(OC(F)(F)c2ccc3cc(COC(=O)C(=C)C)ccc3c2)cc1.C=CC(=O)OCC1CCC(C(F)(F)Oc2ccc(COC(=O)C(=C)C)cc2)CC1.C=CC(=O)OCC1CCC(C2CCC(C(F)(F)Oc3ccc(COC(=O)C(=C)C)cc3)CC2)CC1.C=CC(=O)OCc1ccc(OC(F)(F)C2CCC(C3CCC(COC(=O)C(=C)C)CC3)CC2)cc1.C=CC(=O)OCc1ccc(OC(F)(F)C2CCC(C3CCC(COC(=O)C=C)CC3)CC2)cc1.C=CC(=O)OCc1ccc(OC(F)(F)C2CCC(COC(=O)C(=C)C)CC2)cc1.C=CC(=O)OCc1ccc(OC(F)(F)C2CCC(COC(=O)C=C)CC2)cc1.C=CC(=O)OCc1ccc(OC(F)(F)c2ccc3cc(COC(=O)C(=C)C)ccc3c2)cc1.C=CC(=O)OCc1ccc(OC(F)(F)c2ccc3cc(COC(=O)C=C)ccc3c2)cc1.C=CC(=O)OCc1ccc2cc(C(F)(F)Oc3ccc(COC(=O)C(=C)C)cc3)ccc2c1.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC |
| InChI | InChI=1S/C29H38F2O5.2C28H36F2O5.C27H24F2O5.C27H34F2O5.2C26H22F2O5.C25H20F2O5.C23H28F2O5.2C22H26F2O5.C21H24F2O5.20C2H6/c1-19(2)27(32)34-17-21-5-9-23(10-6-21)24-11-13-25(14-12-24)29(30,31)36-26-15-7-22(8-16-26)18-35-28(33)20(3)4;1-4-26(31)33-17-21-7-15-25(16-8-21)35-28(29,30)24-13-11-23(12-14-24)22-9-5-20(6-10-22)18-34-27(32)19(2)3;1-4-26(31)33-17-20-5-9-22(10-6-20)23-11-13-24(14-12-23)28(29,30)35-25-15-7-21(8-16-25)18-34-27(32)19(2)3;1-17(2)25(30)32-15-19-6-11-24(12-7-19)34-27(28,29)23-10-9-21-13-20(5-8-22(21)14-23)16-33-26(31)18(3)4;1-3-25(30)32-17-19-5-9-21(10-6-19)22-11-13-23(14-12-22)27(28,29)34-24-15-7-20(8-16-24)18-33-26(31)4-2;1-4-24(29)31-16-19-5-8-21-14-22(10-9-20(21)13-19)26(27,28)33-23-11-6-18(7-12-23)15-32-25(30)17(2)3;1-4-24(29)31-15-18-6-11-23(12-7-18)33-26(27,28)22-10-9-20-13-19(5-8-21(20)14-22)16-32-25(30)17(2)3;1-3-23(28)30-15-17-6-11-22(12-7-17)32-25(26,27)21-10-9-19-13-18(5-8-20(19)14-21)16-31-24(29)4-2;1-15(2)21(26)28-13-17-5-9-19(10-6-17)23(24,25)30-20-11-7-18(8-12-20)14-29-22(27)16(3)4;1-4-20(25)27-13-17-7-11-19(12-8-17)29-22(23,24)18-9-5-16(6-10-18)14-28-21(26)15(2)3;1-4-20(25)27-13-16-5-9-18(10-6-16)22(23,24)29-19-11-7-17(8-12-19)14-28-21(26)15(2)3;1-3-19(24)26-13-15-5-9-17(10-6-15)21(22,23)28-18-11-7-16(8-12-18)14-27-20(25)4-2;20*1-2/h7-8,15-16,21,23-25H,1,3,5-6,9-14,17-18H2,2,4H3;2*4,7-8,15-16,20,22-24H,1-2,5-6,9-14,17-18H2,3H3;5-14H,1,3,15-16H2,2,4H3;3-4,7-8,15-16,19,21-23H,1-2,5-6,9-14,17-18H2;2*4-14H,1-2,15-16H2,3H3;3-14H,1-2,15-16H2;7-8,11-12,17,19H,1,3,5-6,9-10,13-14H2,2,4H3;2*4,7-8,11-12,16,18H,1-2,5-6,9-10,13-14H2,3H3;3-4,7-8,11-12,15,17H,1-2,5-6,9-10,13-14H2;20*1-2H3 |
| InChIKey | SKMZJGRPYQABSP-UHFFFAOYSA-N |
| XLogP | 89.52 |
| TPSA | 741.96 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 60 |
| Rotatable Bonds | 112 |
| Heavy Atoms | 428 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 6007.32 |
| LogP ≤ 5 | 89.52 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 60 |