trans-Isoflavan-4-ol
TL;DR: trans-Isoflavan-4-ol (CAS 20986-77-0) is a chemical compound with molecular formula C15H14O2 and molecular weight 226.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4S)-3-phenyl-3,4-dihydro-2H-chromen-4-ol
Also Known As: trans-Isoflavan-4-ol, (3R,4S)-3-phenyl-3,4-dihydro-2H-chromen-4-ol, 3beta-Phenyl-3,4-dihydro-2H-1-benzopyran-4alpha-ol, (3R,4S)-3-phenyl-3,4-dihydro-2H-1-benzopyran-4-ol
| Molecular Formula | C15H14O2 |
|---|---|
| Molecular Weight | 226.10 g/mol |
| LogP | 2.8962 |
| Topological Polar Surface Area | 29.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.09938 |
| Heavy Atoms | 17 |
| Complexity | 507.3401 |
Chemical Identifiers
| CAS Number | 20986-77-0 |
|---|---|
| SMILES | C1[C@H]([C@@H](C2=CC=CC=C2O1)O)C3=CC=CC=C3 |
Product Overview
trans-Isoflavan-4-ol (CAS 20986-77-0), with molecular formula C15H14O2 and molecular weight 226.10 g/mol. IUPAC: (3R,4S)-3-phenyl-3,4-dihydro-2H-chromen-4-ol.
Chemical Property Profile of trans-Isoflavan-4-ol
Property Insights of trans-Isoflavan-4-ol
The XLogP value of 2.8962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-Isoflavan-4-ol. With a topological polar surface area (TPSA) of 29.46 Ų, trans-Isoflavan-4-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-Isoflavan-4-ol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of trans-Isoflavan-4-ol?
The CAS number of trans-Isoflavan-4-ol is 20986-77-0.
What is the molecular formula of trans-Isoflavan-4-ol?
The molecular formula of trans-Isoflavan-4-ol is C15H14O2.
What is the molecular weight of trans-Isoflavan-4-ol?
The molecular weight of trans-Isoflavan-4-ol is 226.10 g/mol.
Where can I buy trans-Isoflavan-4-ol?
You can request a quote for trans-Isoflavan-4-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-Isoflavan-4-ol?
Yes, KEHONG BIO provides custom synthesis services for trans-Isoflavan-4-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.