TL;DR: 1,2-Dodecanediol (CAS 1119-87-5) is a chemical compound with molecular formula C12H26O2 and molecular weight 202.19328 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dodecane-1,2-diol
Also Known As: 1,2-Dodecanediol, Dodecane-1,2-diol, Lauryl glycol, 1,2-Dihydroxydodecane, 1,2-dodecandiol
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H26O2 |
| Molecular Weight | 202.19328 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 202.19328 Da |
| Heavy Atoms | 14 |
| Complexity | 104.0 |
| SMILES | CCCCCCCCCCC(CO)O |
| InChIKey | ZITKDVFRMRXIJQ-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 1,2-Dodecanediol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 1,2-Dodecanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Dodecanediol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,2-Dodecanediol is 1119-87-5.
The molecular formula of 1,2-Dodecanediol is C12H26O2.
The molecular weight of 1,2-Dodecanediol is 202.19328 g/mol.
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