1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid
TL;DR: 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid (CAS 7471-41-2) is a chemical compound with molecular formula C20H22O6 and molecular weight 358.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid
Also Known As: 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid, 1-(CARBOXYMETHYL)-5,9-DIMETHOXY-2-METHYL-1,2,3,4-TETRAHYDROPHENANTHRENE-2-CARBOXYLIC ACID
| Molecular Formula | C20H22O6 |
|---|---|
| Molecular Weight | 358.14 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 358.14163 |
| Heavy Atoms | 26 |
| Complexity | 548.0 |
Chemical Identifiers
| CAS Number | 7471-41-2 |
|---|---|
| SMILES | CC1(CCC2=C3C(=C(C=C2C1CC(=O)O)OC)C=CC=C3OC)C(=O)O |
| InChIKey | HQYCLMHOLJQIKI-UHFFFAOYSA-N |
Product Overview
1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid (CAS 7471-41-2), with molecular formula C20H22O6 and molecular weight 358.14 g/mol. IUPAC: 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid.
Chemical Property Profile of 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid
Property Insights of 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid. Following Lipinski's Rule of Five, 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid has 2 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 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid?
The CAS number of 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid is 7471-41-2.
What is the molecular formula of 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid?
The molecular formula of 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid is C20H22O6.
What is the molecular weight of 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid?
The molecular weight of 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid is 358.14 g/mol.
Where can I buy 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid?
You can request a quote for 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(carboxymethyl)-5,9-dimethoxy-2-methyl-3,4-dihydro-1H-phenanthrene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.