C336H534 — CID 161249358
1-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]-4-methylbenzene;1-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]-4-[(4-methylcyclohexyl)methyl]benzene;bis(1-[(4-ethylcyclohexyl)methyl]-4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]benzene);1-[(4-ethylcyclohexyl)methyl]-4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]benzene;bis(1-ethyl-4-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]benzene);1-ethyl-4-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]cyclohexane;1-ethyl-4-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]phenyl]methyl]benzene;1-ethyl-4-[[4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]benzene;1-ethyl-4-[[4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]phenyl]methyl]benzene (PubChem CID 161249358) has the molecular formula C336H534 and a molecular weight of 4573.97 g/mol. Its IUPAC name is 1-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]-4-methylbenzene;1-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]-4-[(4-methylcyclohexyl)methyl]benzene;bis(1-[(4-ethylcyclohexyl)methyl]-4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]benzene);1-[(4-ethylcyclohexyl)methyl]-4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]benzene;bis(1-ethyl-4-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]benzene);1-ethyl-4-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]cyclohexane;1-ethyl-4-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]phenyl]methyl]benzene;1-ethyl-4-[[4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]benzene;1-ethyl-4-[[4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]phenyl]methyl]benzene.
| Compound Name | 1-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]-4-methylbenzene;1-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]-4-[(4-methylcyclohexyl)methyl]benzene;bis(1-[(4-ethylcyclohexyl)methyl]-4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]benzene);1-[(4-ethylcyclohexyl)methyl]-4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]benzene;bis(1-ethyl-4-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]benzene);1-ethyl-4-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]cyclohexane;1-ethyl-4-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]phenyl]methyl]benzene;1-ethyl-4-[[4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]benzene;1-ethyl-4-[[4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]phenyl]methyl]benzene |
|---|---|
| PubChem CID | 161249358 |
| Molecular Formula | C336H534 |
| Molecular Weight | 4573.97 g/mol |
| Exact Mass | 4570.18 |
| IUPAC Name | 1-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]-4-methylbenzene;1-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]-4-[(4-methylcyclohexyl)methyl]benzene;bis(1-[(4-ethylcyclohexyl)methyl]-4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]benzene);1-[(4-ethylcyclohexyl)methyl]-4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]benzene;bis(1-ethyl-4-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]benzene);1-ethyl-4-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]cyclohexane;1-ethyl-4-[[4-[[4-[(4-ethylcyclohexyl)methyl]cyclohexyl]methyl]phenyl]methyl]benzene;1-ethyl-4-[[4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]benzene;1-ethyl-4-[[4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]phenyl]methyl]benzene |
| SMILES | CCC1CCC(CC2CCC(CC3CCC(CC4CCC(CC)CC4)CC3)CC2)CC1.CCC1CCC(CC2CCC(CC3CCC(Cc4ccc(C)cc4)CC3)CC2)CC1.CCC1CCC(CC2CCC(Cc3ccc(CC4CCC(C)CC4)cc3)CC2)CC1.CCC1CCC(Cc2ccc(CC3CCC(CC4CCC(C)CC4)CC3)cc2)CC1.CCC1CCC(Cc2ccc(CC3CCC(CC4CCC(CC)CC4)CC3)cc2)CC1.CCC1CCC(Cc2ccc(CC3CCC(CC4CCC(CC)CC4)CC3)cc2)CC1.CCc1ccc(CC2CCC(CC3CCC(CC4CCC(C)CC4)CC3)CC2)cc1.CCc1ccc(CC2CCC(CC3CCC(CC4CCC(CC)CC4)CC3)CC2)cc1.CCc1ccc(CC2CCC(CC3CCC(CC4CCC(CC)CC4)CC3)CC2)cc1.CCc1ccc(Cc2ccc(CC3CCC(CC4CCC(C)CC4)CC3)cc2)cc1.CCc1ccc(Cc2ccc(CC3CCC(CC4CCC(CC)CC4)CC3)cc2)cc1 |
| InChI | InChI=1S/C31H56.4C31H50.C31H44.4C30H48.C30H42/c6*1-3-24-5-9-26(10-6-24)21-28-13-17-30(18-14-28)23-31-19-15-29(16-20-31)22-27-11-7-25(4-2)8-12-27;5*1-3-24-8-10-26(11-9-24)21-28-16-18-30(19-17-28)22-29-14-12-27(13-15-29)20-25-6-4-23(2)5-7-25/h24-31H,3-23H2,1-2H3;2*13-14,17-18,24-27,29,31H,3-12,15-16,19-23H2,1-2H3;2*5-6,9-10,25,27-31H,3-4,7-8,11-23H2,1-2H3;5-6,9-10,13-14,17-18,25,27,29,31H,3-4,7-8,11-12,15-16,19-23H2,1-2H3;16-19,23-27,29H,3-15,20-22H2,1-2H3;12-15,23-26,28,30H,3-11,16-22H2,1-2H3;8-11,23,25,27-30H,3-7,12-22H2,1-2H3;4-7,24,26-30H,3,8-22H2,1-2H3;8-11,16-19,23,25,27,29H,3-7,12-15,20-22H2,1-2H3 |
| InChIKey | VBBHDKSBUQHFAA-UHFFFAOYSA-N |
| XLogP | 101.19 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 83 |
| Heavy Atoms | 336 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4573.97 |
| LogP ≤ 5 | 101.19 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |