Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate
TL;DR: Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate (CAS 128397-31-9) is a chemical compound with molecular formula C18H15NO6 and molecular weight 341.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate
Also Known As: Ariskanin A, methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate, 3,4-Dimethoxy-10-nitrophenanthrene-1-carboxylic acid methyl ester
| Molecular Formula | C18H15NO6 |
|---|---|
| Molecular Weight | 341.09 g/mol |
| LogP | 3.705 |
| Topological Polar Surface Area | 87.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.08994 |
| Heavy Atoms | 25 |
| Complexity | 1011.5305 |
Chemical Identifiers
| CAS Number | 128397-31-9 |
|---|---|
| SMILES | COC1=C(C2=C(C(=C1)C(=O)OC)C(=CC3=CC=CC=C32)[N+](=O)[O-])OC |
Product Overview
Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate (CAS 128397-31-9), with molecular formula C18H15NO6 and molecular weight 341.09 g/mol. IUPAC: methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate.
Chemical Property Profile of Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate
Property Insights of Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate
The XLogP value of 3.705 indicates that Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate. Following Lipinski's Rule of Five, Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate has 0 hydrogen bond donor(s) and 6 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 Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate?
The CAS number of Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate is 128397-31-9.
What is the molecular formula of Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate?
The molecular formula of Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate is C18H15NO6.
What is the molecular weight of Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate?
The molecular weight of Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate is 341.09 g/mol.
Where can I buy Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate?
You can request a quote for Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3,4-dimethoxy-10-nitrophenanthrene-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.