TL;DR: (2E)-4,4-dimethylhexa-2,5-dien-1-ol (CAS 141993-24-0) is a chemical compound with molecular formula C8H14O and molecular weight 126.10446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E)-4,4-dimethylhexa-2,5-dien-1-ol
Also Known As: 4,4-dimethylhexa-2,5-dien-1-ol, (2E)-4,4-dimethylhexa-2,5-dien-1-ol, (E)-4,4-Dimethyl-2,5-hexadien-1-ol
| Molecular Formula | C8H14O |
| Molecular Weight | 126.10446 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 126.10446 Da |
| Heavy Atoms | 9 |
| Complexity | 112.0 |
| SMILES | CC(C)(C=C)/C=C/CO |
| InChIKey | BKIKIFZEVPEXMS-AATRIKPKSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-4,4-dimethylhexa-2,5-dien-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, (2E)-4,4-dimethylhexa-2,5-dien-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-4,4-dimethylhexa-2,5-dien-1-ol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2E)-4,4-dimethylhexa-2,5-dien-1-ol is 141993-24-0.
The molecular formula of (2E)-4,4-dimethylhexa-2,5-dien-1-ol is C8H14O.
The molecular weight of (2E)-4,4-dimethylhexa-2,5-dien-1-ol is 126.10446 g/mol.
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