5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid
TL;DR: 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid (CAS 4385-77-7) is a chemical compound with molecular formula C9H12O4 and molecular weight 184.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-4-(methoxymethyl)furan-2-carboxylic acid
Also Known As: 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid, starbld0029603, 5-ethyl-4-(methoxymethyl)furan-2-carboxylic acid, 3-(3-Pyridinyl)benzoic acid, BAS 08173136
| Molecular Formula | C9H12O4 |
|---|---|
| Molecular Weight | 184.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 59.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 184.07356 |
| Heavy Atoms | 13 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 4385-77-7 |
|---|---|
| SMILES | CCC1=C(C=C(O1)C(=O)O)COC |
| InChIKey | LNTFJABOWLAOHQ-UHFFFAOYSA-N |
Product Overview
5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid (CAS 4385-77-7), with molecular formula C9H12O4 and molecular weight 184.07 g/mol. IUPAC: 5-ethyl-4-(methoxymethyl)furan-2-carboxylic acid.
Chemical Property Profile of 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid
Property Insights of 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid. With a topological polar surface area (TPSA) of 59.7 Ų, 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid has 1 hydrogen bond donor(s) and 4 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 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid?
The CAS number of 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid is 4385-77-7.
What is the molecular formula of 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid?
The molecular formula of 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid is C9H12O4.
What is the molecular weight of 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid?
The molecular weight of 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid is 184.07 g/mol.
Where can I buy 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid?
You can request a quote for 5-Ethyl-4-methoxymethyl-furan-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 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-4-methoxymethyl-furan-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.