C305H390O10 — CID 161060836
4-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]butan-1-ol;2-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]ethanol;[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]methanol;5-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]pentan-1-ol;3-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]propan-1-ol;4-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]butan-1-ol;2-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]ethanol;[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]methanol;5-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]pentan-1-ol;3-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]propan-1-ol (PubChem CID 161060836) has the molecular formula C305H390O10 and a molecular weight of 4216.46 g/mol. Its IUPAC name is 4-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]butan-1-ol;2-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]ethanol;[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]methanol;5-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]pentan-1-ol;3-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]propan-1-ol;4-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]butan-1-ol;2-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]ethanol;[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]methanol;5-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]pentan-1-ol;3-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]propan-1-ol.
| Compound Name | 4-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]butan-1-ol;2-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]ethanol;[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]methanol;5-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]pentan-1-ol;3-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]propan-1-ol;4-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]butan-1-ol;2-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]ethanol;[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]methanol;5-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]pentan-1-ol;3-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]propan-1-ol |
|---|---|
| PubChem CID | 161060836 |
| Molecular Formula | C305H390O10 |
| Molecular Weight | 4216.46 g/mol |
| Exact Mass | 4213.00 |
| IUPAC Name | 4-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]butan-1-ol;2-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]ethanol;[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]methanol;5-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]pentan-1-ol;3-[4-[4-[2-(4-butylphenyl)ethyl]-2-ethylphenyl]-3-ethylphenyl]propan-1-ol;4-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]butan-1-ol;2-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]ethanol;[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]methanol;5-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]pentan-1-ol;3-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]propan-1-ol |
| SMILES | CCCCc1ccc(CCc2ccc(-c3ccc(CCCCCO)cc3CC)c(CC)c2)cc1.CCCCc1ccc(CCc2ccc(-c3ccc(CCCCO)cc3CC)c(CC)c2)cc1.CCCCc1ccc(CCc2ccc(-c3ccc(CCCO)cc3CC)c(CC)c2)cc1.CCCCc1ccc(CCc2ccc(-c3ccc(CCO)cc3CC)c(CC)c2)cc1.CCCCc1ccc(CCc2ccc(-c3ccc(CO)cc3CC)c(CC)c2)cc1.CCCc1ccc(CCc2ccc(-c3ccc(CCCCCO)cc3CC)c(CC)c2)cc1.CCCc1ccc(CCc2ccc(-c3ccc(CCCCO)cc3CC)c(CC)c2)cc1.CCCc1ccc(CCc2ccc(-c3ccc(CCCO)cc3CC)c(CC)c2)cc1.CCCc1ccc(CCc2ccc(-c3ccc(CCO)cc3CC)c(CC)c2)cc1.CCCc1ccc(CCc2ccc(-c3ccc(CO)cc3CC)c(CC)c2)cc1 |
| InChI | InChI=1S/C33H44O.2C32H42O.2C31H40O.2C30H38O.2C29H36O.C28H34O/c1-4-7-11-26-13-15-27(16-14-26)17-18-29-20-22-33(31(6-3)25-29)32-21-19-28(24-30(32)5-2)12-9-8-10-23-34;1-4-10-25-12-14-26(15-13-25)16-17-28-19-21-32(30(6-3)24-28)31-20-18-27(23-29(31)5-2)11-8-7-9-22-33;1-4-7-10-25-12-14-26(15-13-25)16-17-28-19-21-32(30(6-3)24-28)31-20-18-27(11-8-9-22-33)23-29(31)5-2;1-4-9-24-11-13-25(14-12-24)15-16-27-18-20-31(29(6-3)23-27)30-19-17-26(10-7-8-21-32)22-28(30)5-2;1-4-7-9-24-11-13-25(14-12-24)15-16-27-18-20-31(29(6-3)23-27)30-19-17-26(10-8-21-32)22-28(30)5-2;1-4-8-23-10-12-24(13-11-23)14-15-26-17-19-30(28(6-3)22-26)29-18-16-25(9-7-20-31)21-27(29)5-2;1-4-7-8-23-9-11-24(12-10-23)13-14-25-15-17-29(27(5-2)21-25)30-18-16-26(19-20-31)22-28(30)6-3;1-4-7-22-8-10-23(11-9-22)12-13-24-14-16-28(26(5-2)20-24)29-17-15-25(18-19-30)21-27(29)6-3;1-4-7-8-22-9-11-23(12-10-22)13-14-24-15-17-28(26(5-2)19-24)29-18-16-25(21-30)20-27(29)6-3;1-4-7-21-8-10-22(11-9-21)12-13-23-14-16-27(25(5-2)18-23)28-17-15-24(20-29)19-26(28)6-3/h13-16,19-22,24-25,34H,4-12,17-18,23H2,1-3H3;2*12-15,18-21,23-24,33H,4-11,16-17,22H2,1-3H3;2*11-14,17-20,22-23,32H,4-10,15-16,21H2,1-3H3;10-13,16-19,21-22,31H,4-9,14-15,20H2,1-3H3;9-12,15-18,21-22,31H,4-8,13-14,19-20H2,1-3H3;8-11,14-17,20-21,30H,4-7,12-13,18-19H2,1-3H3;9-12,15-20,30H,4-8,13-14,21H2,1-3H3;8-11,14-19,29H,4-7,12-13,20H2,1-3H3 |
| InChIKey | UDJHEPXBZDHSSM-UHFFFAOYSA-N |
| XLogP | 74.06 |
| TPSA | 202.30 Ų |
| H-Bond Donors | 10 |
| H-Bond Acceptors | 10 |
| Rotatable Bonds | 115 |
| Heavy Atoms | 315 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4216.46 |
| LogP ≤ 5 | 74.06 |
| H-Bond Donors ≤ 5 | 10 |
| H-Bond Acceptors ≤ 10 | 10 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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