Isomucronulatol
TL;DR: Isomucronulatol (CAS 73353-84-1) is a chemical compound with molecular formula C17H18O5 and molecular weight 302.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxy-3,4-dimethoxyphenyl)-3,4-dihydro-2H-chromen-7-ol
Also Known As: Isomucronulatol, Astraisoflavan, Isomucronuratol, DL-Isomucronulatol, 7,2'-Dihydroxy-3',4'-dimethoxyisoflavan
| Molecular Formula | C17H18O5 |
|---|---|
| Molecular Weight | 302.12 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.11542 |
| Heavy Atoms | 22 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 73353-84-1 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)C2CC3=C(C=C(C=C3)O)OC2)O)OC |
| InChIKey | NQRBAPDEZYMKFL-UHFFFAOYSA-N |
Product Overview
Isomucronulatol (CAS 73353-84-1), with molecular formula C17H18O5 and molecular weight 302.12 g/mol. IUPAC: 3-(2-hydroxy-3,4-dimethoxyphenyl)-3,4-dihydro-2H-chromen-7-ol.
Chemical Property Profile of Isomucronulatol
Property Insights of Isomucronulatol
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isomucronulatol. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Isomucronulatol. Following Lipinski's Rule of Five, Isomucronulatol has 2 hydrogen bond donor(s) and 5 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 Isomucronulatol?
The CAS number of Isomucronulatol is 73353-84-1.
What is the molecular formula of Isomucronulatol?
The molecular formula of Isomucronulatol is C17H18O5.
What is the molecular weight of Isomucronulatol?
The molecular weight of Isomucronulatol is 302.12 g/mol.
Where can I buy Isomucronulatol?
You can request a quote for Isomucronulatol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isomucronulatol?
Yes, KEHONG BIO provides custom synthesis services for Isomucronulatol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.