methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate
TL;DR: methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate (CAS 7471-42-3) is a chemical compound with molecular formula C20H22O5 and molecular weight 342.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate
Also Known As: methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate, methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihyd, METHYL 1-HYDROXY-1-(2-METHOXY-2-OXOETHYL)-2-METHYL-1,2,3,4-TETRAHYDROPHENANTHRENE-2-CARBOXYLATE
| Molecular Formula | C20H22O5 |
|---|---|
| Molecular Weight | 342.15 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.14673 |
| Heavy Atoms | 25 |
| Complexity | 532.0 |
Chemical Identifiers
| CAS Number | 7471-42-3 |
|---|---|
| SMILES | CC1(CCC2=C(C1(CC(=O)OC)O)C=CC3=CC=CC=C23)C(=O)OC |
| InChIKey | AWOATJQDUAUSOY-UHFFFAOYSA-N |
Product Overview
methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate (CAS 7471-42-3), with molecular formula C20H22O5 and molecular weight 342.15 g/mol. IUPAC: methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate.
Chemical Property Profile of methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate
Property Insights of methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate
The XLogP value of 3.1 indicates that methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate. Following Lipinski's Rule of Five, methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate has 1 hydrogen bond donor(s) and 5 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 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate?
The CAS number of methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate is 7471-42-3.
What is the molecular formula of methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate?
The molecular formula of methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate is C20H22O5.
What is the molecular weight of methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate?
The molecular weight of methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate is 342.15 g/mol.
Where can I buy methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate?
You can request a quote for methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 1-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-3,4-dihydrophenanthrene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.