Dibenzylbutyrolactone
TL;DR: Dibenzylbutyrolactone (CAS 34444-37-6) is a chemical compound with molecular formula C20H22O7 and molecular weight 374.13657 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-hydroxy-3,4-bis[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one
Also Known As: Nortrachelogenin, Epinortrachelogenin, Wikstromol, Dibenzylbutyrolactone, (+)-Nortrachelogenin
Technical Specifications
| Molecular Formula | C20H22O7 |
| Molecular Weight | 374.13657 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 374.13657 Da |
| Heavy Atoms | 27 |
| Complexity | 513.0 |
| SMILES | COC1=C(C=CC(=C1)CC2COC(=O)C2(CC3=CC(=C(C=C3)O)OC)O)O |
| InChIKey | ZITBJWXLODLDRH-UHFFFAOYSA-N |
Chemical Property Profile of Dibenzylbutyrolactone
Property Insights of Dibenzylbutyrolactone
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dibenzylbutyrolactone. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dibenzylbutyrolactone. Following Lipinski's Rule of Five, Dibenzylbutyrolactone has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Dibenzylbutyrolactone?
The CAS number of Dibenzylbutyrolactone is 34444-37-6.
What is the molecular formula of Dibenzylbutyrolactone?
The molecular formula of Dibenzylbutyrolactone is C20H22O7.
What is the molecular weight of Dibenzylbutyrolactone?
The molecular weight of Dibenzylbutyrolactone is 374.13657 g/mol.
Where can I buy Dibenzylbutyrolactone?
You can request a quote for Dibenzylbutyrolactone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dibenzylbutyrolactone?
Yes, CoreyChem provides custom synthesis services for Dibenzylbutyrolactone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.