Nigerone
TL;DR: Nigerone (CAS 76069-41-5) is a chemical compound with molecular formula C32H26O10 and molecular weight 570.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-10-(5-hydroxy-6,8-dimethoxy-2-methyl-4-oxobenzo[g]chromen-10-yl)-6,8-dimethoxy-2-methylbenzo[g]chromen-4-one
Also Known As: NIGERONE, (R)-Nigerone, J2.384.524E, J2.432.787F, 5-hydroxy-10-(5-hydroxy-6,8-dimethoxy-2-methyl-4-oxobenzo[g]chromen-10-yl)-6,8-dimethoxy-2-methylbenzo[g]chromen-4-one
| Molecular Formula | C32H26O10 |
|---|---|
| Molecular Weight | 570.15 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 570.1526 |
| Heavy Atoms | 42 |
| Complexity | 1030.0 |
| Melting Point | 330 °C |
Chemical Identifiers
| CAS Number | 76069-41-5 |
|---|---|
| SMILES | CC1=CC(=O)C2=C(C3=C(C=C(C=C3OC)OC)C(=C2O1)C4=C5C(=C(C6=C4C=C(C=C6OC)OC)O)C(=O)C=C(O5)C)O |
| InChIKey | MBDIPBHBEVOYQB-UHFFFAOYSA-N |
Product Overview
Nigerone (CAS 76069-41-5), with molecular formula C32H26O10 and molecular weight 570.15 g/mol. IUPAC: 5-hydroxy-10-(5-hydroxy-6,8-dimethoxy-2-methyl-4-oxobenzo[g]chromen-10-yl)-6,8-dimethoxy-2-methylbenzo[g]chromen-4-one.
Chemical Property Profile of Nigerone
Property Insights of Nigerone
The XLogP value of 6.3 indicates that Nigerone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Nigerone. Following Lipinski's Rule of Five, Nigerone has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nigerone?
The CAS number of Nigerone is 76069-41-5.
What is the molecular formula of Nigerone?
The molecular formula of Nigerone is C32H26O10.
What is the molecular weight of Nigerone?
The molecular weight of Nigerone is 570.15 g/mol.
Where can I buy Nigerone?
You can request a quote for Nigerone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nigerone?
Yes, KEHONG BIO provides custom synthesis services for Nigerone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.