beta-Dihydrorotenone
TL;DR: beta-Dihydrorotenone (CAS 4440-77-1) is a chemical compound with molecular formula C23H20O7 and molecular weight 408.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17,18-dimethoxy-7,7-dimethyl-2,8,21-trioxapentacyclo[12.8.0.03,12.04,9.015,20]docosa-1(14),3(12),4(9),10,15,17,19-heptaene-13,22-dione
Also Known As: beta-Dihydrorotenone, beta-Rotenone, dihydro-, Trimorpholinophosphine oxide, 1H-Bis(1)benzopyrano(3,4-b:6'5'-e)pyran-7,13-dione, 2,3-dihydro-9,10-dimethoxy-3,3-dimethyl-, 2,3-Dihydro-9,10-dimethoxy-3,3-dimethyl-1H-bis(1)benzopyrano(3,4-b:6'5'-e)pyran-7,13-dione
| Molecular Formula | C23H20O7 |
|---|---|
| Molecular Weight | 408.12 g/mol |
| LogP | 4.1734 |
| Topological Polar Surface Area | 88.11 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 408.1209 |
| Heavy Atoms | 30 |
| Complexity | 1456.6846 |
Chemical Identifiers
| CAS Number | 4440-77-1 |
|---|---|
| SMILES | CC1(CCC2=C(O1)C=CC3=C2OC4=C(C3=O)C5=CC(=C(C=C5OC4=O)OC)OC)C |
Product Overview
beta-Dihydrorotenone (CAS 4440-77-1), with molecular formula C23H20O7 and molecular weight 408.12 g/mol. IUPAC: 17,18-dimethoxy-7,7-dimethyl-2,8,21-trioxapentacyclo[12.8.0.03,12.04,9.015,20]docosa-1(14),3(12),4(9),10,15,17,19-heptaene-13,22-dione.
Chemical Property Profile of beta-Dihydrorotenone
Property Insights of beta-Dihydrorotenone
The XLogP value of 4.1734 indicates that beta-Dihydrorotenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.11 Ų falls within the moderate polarity range, balancing permeability and solubility for beta-Dihydrorotenone. Following Lipinski's Rule of Five, beta-Dihydrorotenone has 0 hydrogen bond donor(s) and 7 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 beta-Dihydrorotenone?
The CAS number of beta-Dihydrorotenone is 4440-77-1.
What is the molecular formula of beta-Dihydrorotenone?
The molecular formula of beta-Dihydrorotenone is C23H20O7.
What is the molecular weight of beta-Dihydrorotenone?
The molecular weight of beta-Dihydrorotenone is 408.12 g/mol.
Where can I buy beta-Dihydrorotenone?
You can request a quote for beta-Dihydrorotenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-Dihydrorotenone?
Yes, KEHONG BIO provides custom synthesis services for beta-Dihydrorotenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.