Rutamarin
TL;DR: Rutamarin (CAS 14882-94-1) is a chemical compound with molecular formula C21H24O5 and molecular weight 356.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-(2-methylbut-3-en-2-yl)-7-oxo-2,3-dihydrofuro[3,2-g]chromen-2-yl]propan-2-yl acetate
Also Known As: Rutamarin, Chalepin acetate, (+/-)-Rutamarin, (+)-Rutamarin, Aspergillus acid A
| Molecular Formula | C21H24O5 |
|---|---|
| Molecular Weight | 356.16 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.16238 |
| Heavy Atoms | 26 |
| Complexity | 645.0 |
| Melting Point | 107 - 108 °C |
Chemical Identifiers
| CAS Number | 14882-94-1 |
|---|---|
| SMILES | CC(=O)OC(C)(C)C1CC2=C(O1)C=C3C(=C2)C=C(C(=O)O3)C(C)(C)C=C |
| InChIKey | AWMHMGFGCLBSAY-UHFFFAOYSA-N |
Product Overview
Rutamarin (CAS 14882-94-1), with molecular formula C21H24O5 and molecular weight 356.16 g/mol. IUPAC: 2-[6-(2-methylbut-3-en-2-yl)-7-oxo-2,3-dihydrofuro[3,2-g]chromen-2-yl]propan-2-yl acetate.
Chemical Property Profile of Rutamarin
Property Insights of Rutamarin
The XLogP value of 4.4 indicates that Rutamarin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Rutamarin. Following Lipinski's Rule of Five, Rutamarin has 0 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 Rutamarin?
The CAS number of Rutamarin is 14882-94-1.
What is the molecular formula of Rutamarin?
The molecular formula of Rutamarin is C21H24O5.
What is the molecular weight of Rutamarin?
The molecular weight of Rutamarin is 356.16 g/mol.
Where can I buy Rutamarin?
You can request a quote for Rutamarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rutamarin?
Yes, KEHONG BIO provides custom synthesis services for Rutamarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.