1,1-Diphenyl-butane-1,2-diol
TL;DR: 1,1-Diphenyl-butane-1,2-diol (CAS 108843-02-3) is a chemical compound with molecular formula C16H18O2 and molecular weight 242.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1-diphenylbutane-1,2-diol
Also Known As: 1,1-diphenylbutane-1,2-diol, 1,1-DIPHENYL-BUTANE-1,2-DIOL, 683-018-7
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H18O2 |
| Molecular Weight | 242.13068 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.13068 Da |
| Heavy Atoms | 18 |
| Complexity | 221.0 |
| SMILES | CCC(C(C1=CC=CC=C1)(C2=CC=CC=C2)O)O |
| InChIKey | DWBLJCMBQHQWRY-UHFFFAOYSA-N |
Chemical Property Profile of 1,1-Diphenyl-butane-1,2-diol
Property Insights of 1,1-Diphenyl-butane-1,2-diol
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Diphenyl-butane-1,2-diol. With a topological polar surface area (TPSA) of 40.5 Ų, 1,1-Diphenyl-butane-1,2-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Diphenyl-butane-1,2-diol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,1-Diphenyl-butane-1,2-diol?
The CAS number of 1,1-Diphenyl-butane-1,2-diol is 108843-02-3.
What is the molecular formula of 1,1-Diphenyl-butane-1,2-diol?
The molecular formula of 1,1-Diphenyl-butane-1,2-diol is C16H18O2.
What is the molecular weight of 1,1-Diphenyl-butane-1,2-diol?
The molecular weight of 1,1-Diphenyl-butane-1,2-diol is 242.13068 g/mol.
Where can I buy 1,1-Diphenyl-butane-1,2-diol?
You can request a quote for 1,1-Diphenyl-butane-1,2-diol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1-Diphenyl-butane-1,2-diol?
Yes, CoreyChem provides custom synthesis services for 1,1-Diphenyl-butane-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.