((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid
TL;DR: ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid (CAS 63754-83-6) is a chemical compound with molecular formula C13H14O7 and molecular weight 282.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(2-hydroxyethoxy)-3-methoxyphenyl]methylidene]propanedioic acid
Also Known As: EINECS 264-444-9, ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid, [[4-3-methoxyphenyl]methylene]malonicacid, [[4- -3-methoxyphenyl]methylene]malonicacid, [[4-(2-HYDROXYETHOXY)-3-METHOXYPHENYL]METHYLENE]MALONIC ACID
| Molecular Formula | C13H14O7 |
|---|---|
| Molecular Weight | 282.07 g/mol |
| LogP | 0.6189 |
| Topological Polar Surface Area | 113.29 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 282.07394 |
| Heavy Atoms | 20 |
| Complexity | 517.52124 |
Chemical Identifiers
| CAS Number | 63754-83-6 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C=C(C(=O)O)C(=O)O)OCCO |
Product Overview
((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid (CAS 63754-83-6), with molecular formula C13H14O7 and molecular weight 282.07 g/mol. IUPAC: 2-[[4-(2-hydroxyethoxy)-3-methoxyphenyl]methylidene]propanedioic acid.
Chemical Property Profile of ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid
Property Insights of ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid
The XLogP value of 0.6189 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid. The TPSA of 113.29 Ų falls within the moderate polarity range, balancing permeability and solubility for ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid. Following Lipinski's Rule of Five, ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid has 3 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 ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid?
The CAS number of ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid is 63754-83-6.
What is the molecular formula of ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid?
The molecular formula of ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid is C13H14O7.
What is the molecular weight of ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid?
The molecular weight of ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid is 282.07 g/mol.
Where can I buy ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid?
You can request a quote for ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid?
Yes, KEHONG BIO provides custom synthesis services for ((4-(2-Hydroxyethoxy)-3-methoxyphenyl)methylene)malonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.