3(2H)-Isoflavene
TL;DR: 3(2H)-Isoflavene (CAS 6054-00-8) is a chemical compound with molecular formula C15H12O and molecular weight 208.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-2H-chromene
Also Known As: 3-Phenyl-2H-chromene, 3(2H)-Isoflavene, isoflavene, 3-Isoflavene, 3 -isoflavene
| Molecular Formula | C15H12O |
|---|---|
| Molecular Weight | 208.09 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 208.08882 |
| Heavy Atoms | 16 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 6054-00-8 |
|---|---|
| SMILES | C1C(=CC2=CC=CC=C2O1)C3=CC=CC=C3 |
| InChIKey | CNNBJLXLTIKXGJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3(2H)-Isoflavene (CAS 6054-00-8), with molecular formula C15H12O and molecular weight 208.09 g/mol. IUPAC: 3-phenyl-2H-chromene.
Chemical Property Profile of 3(2H)-Isoflavene
Property Insights of 3(2H)-Isoflavene
The XLogP value of 3.4 indicates that 3(2H)-Isoflavene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 3(2H)-Isoflavene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3(2H)-Isoflavene has 0 hydrogen bond donor(s) and 1 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 3(2H)-Isoflavene?
The CAS number of 3(2H)-Isoflavene is 6054-00-8.
What is the molecular formula of 3(2H)-Isoflavene?
The molecular formula of 3(2H)-Isoflavene is C15H12O.
What is the molecular weight of 3(2H)-Isoflavene?
The molecular weight of 3(2H)-Isoflavene is 208.09 g/mol.
Where can I buy 3(2H)-Isoflavene?
You can request a quote for 3(2H)-Isoflavene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3(2H)-Isoflavene?
Yes, KEHONG BIO provides custom synthesis services for 3(2H)-Isoflavene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.