TL;DR: 2,3-Bis(4-hydroxyphenyl)-1,2-propanediol (CAS 139755-03-6) is a chemical compound with molecular formula C15H16O4 and molecular weight 260.10486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3-bis(4-hydroxyphenyl)propane-1,2-diol
Also Known As: 2,3-Bis(4-hydroxyphenyl)-1,2-propanediol, 2,3-bis(4-hydroxyphenyl)propane-1,2-diol, c0790, 1,2-Propanediol,2,3-bis(4-hydroxyphenyl)-, J1.321.974E
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C15H16O4 |
| Molecular Weight | 260.10486 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 80.9 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.10486 Da |
| Heavy Atoms | 19 |
| Complexity | 267.0 |
| SMILES | C1=CC(=CC=C1CC(CO)(C2=CC=C(C=C2)O)O)O |
| InChIKey | ABSPGUJLBOZTPT-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Bis(4-hydroxyphenyl)-1,2-propanediol. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Bis(4-hydroxyphenyl)-1,2-propanediol. Following Lipinski's Rule of Five, 2,3-Bis(4-hydroxyphenyl)-1,2-propanediol has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,3-Bis(4-hydroxyphenyl)-1,2-propanediol is 139755-03-6.
The molecular formula of 2,3-Bis(4-hydroxyphenyl)-1,2-propanediol is C15H16O4.
The molecular weight of 2,3-Bis(4-hydroxyphenyl)-1,2-propanediol is 260.10486 g/mol.
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