1,30-Didehydroxy-1,30-dichloronigericinol
TL;DR: 1,30-Didehydroxy-1,30-dichloronigericinol (CAS 138285-65-1) is a chemical compound with molecular formula C40H68Cl2O8 and molecular weight 746.42914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(chloromethyl)-6-[5-[5-[9-[[6-(1-chloropropan-2-yl)-5-methyloxan-2-yl]methyl]-7-methoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-2-yl]-2-methyloxolan-2-yl]-4-methyloxolan-2-yl]-3,5-dimethyloxan-2-ol
Also Known As: 1,30-Dddn, 1,30-Didehydroxy-1,30-dichloronigericinol, 30-Chloro-2-(chloromethyl)-2-decarboxy-30-deoxynigericin, Nigericin, 30-chloro-2-(chloromethyl)-2-decarboxy-30-deoxy-, 2-(Chloromethyl)-6-[5-[5-[9-[[6-(1-chloropropan-2-yl)-5-methyloxan-2-yl]methyl]-7-methoxy-2,4,6-trimethyl-1,10-dioxaspiro[4.5]decan-2-yl]-2-methyloxolan-2-yl]-4-methyloxolan-2-yl]-3,5-dimethyloxan-2-ol
Technical Specifications
| Molecular Formula | C40H68Cl2O8 |
| Molecular Weight | 746.42914 g/mol |
| XLogP | 8.1 |
| Topological Polar Surface Area (TPSA) | 84.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 746.42914 Da |
| Heavy Atoms | 50 |
| Complexity | 1160.0 |
| SMILES | CC1CCC(OC1C(C)CCl)CC2CC(C(C3(O2)C(CC(O3)(C)C4CCC(O4)(C)C5C(CC(O5)C6C(CC(C(O6)(CCl)O)C)C)C)C)C)OC |
| InChIKey | VRWZQXWRFYMNIL-UHFFFAOYSA-N |
Chemical Property Profile of 1,30-Didehydroxy-1,30-dichloronigericinol
Property Insights of 1,30-Didehydroxy-1,30-dichloronigericinol
The XLogP value of 8.1 indicates that 1,30-Didehydroxy-1,30-dichloronigericinol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,30-Didehydroxy-1,30-dichloronigericinol. Following Lipinski's Rule of Five, 1,30-Didehydroxy-1,30-dichloronigericinol has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,30-Didehydroxy-1,30-dichloronigericinol?
The CAS number of 1,30-Didehydroxy-1,30-dichloronigericinol is 138285-65-1.
What is the molecular formula of 1,30-Didehydroxy-1,30-dichloronigericinol?
The molecular formula of 1,30-Didehydroxy-1,30-dichloronigericinol is C40H68Cl2O8.
What is the molecular weight of 1,30-Didehydroxy-1,30-dichloronigericinol?
The molecular weight of 1,30-Didehydroxy-1,30-dichloronigericinol is 746.42914 g/mol.
Where can I buy 1,30-Didehydroxy-1,30-dichloronigericinol?
You can request a quote for 1,30-Didehydroxy-1,30-dichloronigericinol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,30-Didehydroxy-1,30-dichloronigericinol?
Yes, CoreyChem provides custom synthesis services for 1,30-Didehydroxy-1,30-dichloronigericinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.