C214H297F9Y10-10 — CID 158211235
1,3-difluoro-5-[4-[4-(4-methylcyclohexyl)butyl]cyclohexyl]benzene-2-ide;1,3-difluoro-5-[4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexyl]benzene-2-ide;1,3-difluoro-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene-2-ide;1-fluoro-3-[4-[4-(4-methylcyclohexyl)butyl]cyclohexyl]benzene-6-ide;1-fluoro-3-[4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexyl]benzene-6-ide;1-fluoro-3-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene-6-ide;[4-[4-(4-methylcyclohexyl)butyl]cyclohexyl]benzene;[4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexyl]benzene;[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-(4-methylcyclohexyl)-4-phenylbenzene;decakis(yttrium) (PubChem CID 158211235) has the molecular formula C214H297F9Y10-10 and a molecular weight of 3929.77 g/mol. Its IUPAC name is 1,3-difluoro-5-[4-[4-(4-methylcyclohexyl)butyl]cyclohexyl]benzene-2-ide;1,3-difluoro-5-[4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexyl]benzene-2-ide;1,3-difluoro-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene-2-ide;1-fluoro-3-[4-[4-(4-methylcyclohexyl)butyl]cyclohexyl]benzene-6-ide;1-fluoro-3-[4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexyl]benzene-6-ide;1-fluoro-3-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene-6-ide;[4-[4-(4-methylcyclohexyl)butyl]cyclohexyl]benzene;[4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexyl]benzene;[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-(4-methylcyclohexyl)-4-phenylbenzene;decakis(yttrium).
| Compound Name | 1,3-difluoro-5-[4-[4-(4-methylcyclohexyl)butyl]cyclohexyl]benzene-2-ide;1,3-difluoro-5-[4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexyl]benzene-2-ide;1,3-difluoro-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene-2-ide;1-fluoro-3-[4-[4-(4-methylcyclohexyl)butyl]cyclohexyl]benzene-6-ide;1-fluoro-3-[4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexyl]benzene-6-ide;1-fluoro-3-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene-6-ide;[4-[4-(4-methylcyclohexyl)butyl]cyclohexyl]benzene;[4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexyl]benzene;[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-(4-methylcyclohexyl)-4-phenylbenzene;decakis(yttrium) |
|---|---|
| PubChem CID | 158211235 |
| Molecular Formula | C214H297F9Y10-10 |
| Molecular Weight | 3929.77 g/mol |
| Exact Mass | 3927.37 |
| IUPAC Name | 1,3-difluoro-5-[4-[4-(4-methylcyclohexyl)butyl]cyclohexyl]benzene-2-ide;1,3-difluoro-5-[4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexyl]benzene-2-ide;1,3-difluoro-5-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene-2-ide;1-fluoro-3-[4-[4-(4-methylcyclohexyl)butyl]cyclohexyl]benzene-6-ide;1-fluoro-3-[4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexyl]benzene-6-ide;1-fluoro-3-[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene-6-ide;[4-[4-(4-methylcyclohexyl)butyl]cyclohexyl]benzene;[4-[(E)-2-(4-methylcyclohexyl)ethenyl]cyclohexyl]benzene;[4-[2-(4-methylcyclohexyl)ethyl]cyclohexyl]benzene;1-(4-methylcyclohexyl)-4-phenylbenzene;decakis(yttrium) |
| SMILES | CC1CCC(/C=C/C2CCC(c3cc(F)[c-]c(F)c3)CC2)CC1.CC1CCC(/C=C/C2CCC(c3cc[c-]c(F)c3)CC2)CC1.CC1CCC(/C=C/C2CCC(c3cc[c-]cc3)CC2)CC1.CC1CCC(CCC2CCC(c3cc(F)[c-]c(F)c3)CC2)CC1.CC1CCC(CCC2CCC(c3cc[c-]c(F)c3)CC2)CC1.CC1CCC(CCC2CCC(c3cc[c-]cc3)CC2)CC1.CC1CCC(CCCCC2CCC(c3cc(F)[c-]c(F)c3)CC2)CC1.CC1CCC(CCCCC2CCC(c3cc[c-]c(F)c3)CC2)CC1.CC1CCC(CCCCC2CCC(c3cc[c-]cc3)CC2)CC1.CC1CCC(c2ccc(-c3cc[c-]cc3)cc2)CC1.[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y].[Y] |
| InChI | InChI=1S/C23H33F2.C23H34F.C23H35.C21H29F2.C21H27F2.C21H30F.C21H28F.C21H31.C21H29.C19H21.10Y/c1-17-6-8-18(9-7-17)4-2-3-5-19-10-12-20(13-11-19)21-14-22(24)16-23(25)15-21;1-18-9-11-19(12-10-18)5-2-3-6-20-13-15-21(16-14-20)22-7-4-8-23(24)17-22;1-19-11-13-20(14-12-19)7-5-6-8-21-15-17-23(18-16-21)22-9-3-2-4-10-22;2*1-15-2-4-16(5-3-15)6-7-17-8-10-18(11-9-17)19-12-20(22)14-21(23)13-19;2*1-16-5-7-17(8-6-16)9-10-18-11-13-19(14-12-18)20-3-2-4-21(22)15-20;2*1-17-7-9-18(10-8-17)11-12-19-13-15-21(16-14-19)20-5-3-2-4-6-20;1-15-7-9-17(10-8-15)19-13-11-18(12-14-19)16-5-3-2-4-6-16;;;;;;;;;;/h14-15,17-20H,2-13H2,1H3;4,7,17-21H,2-3,5-6,9-16H2,1H3;3-4,9-10,19-21,23H,5-8,11-18H2,1H3;12-13,15-18H,2-11H2,1H3;6-7,12-13,15-18H,2-5,8-11H2,1H3;2-3,15-19H,5-14H2,1H3;2-3,9-10,15-19H,5-8,11-14H2,1H3;3-6,17-19,21H,7-16H2,1H3;3-6,11-12,17-19,21H,7-10,13-16H2,1H3;3-6,11-15,17H,7-10H2,1H3;;;;;;;;;;/q10*-1;;;;;;;;;;/b;;;;7-6+;;10-9+;;12-11+;;;;;;;;;;; |
| InChIKey | PZUOBXVAEHQXMM-LOBCBXAYSA-N |
| XLogP | 65.65 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 41 |
| Heavy Atoms | 233 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3929.77 |
| LogP ≤ 5 | 65.65 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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