![4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid structure](/static/products/844/844882-34-4.png)
4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid
TL;DR: 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid (CAS 844882-34-4) is a chemical compound with molecular formula C12H19NO3 and molecular weight 225.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(diethylaminomethyl)-5-ethylfuran-2-carboxylic acid
Also Known As: ChemDiv2_001884, 4-[(DIETHYLAMINO)METHYL]-5-ETHYL-2-FUROIC ACID, CHEMBRDG-BB9071724, BAS 09105877, 4-(diethylaminomethyl)-5-ethylfuran-2-carboxylic acid
| Molecular Formula | C12H19NO3 |
|---|---|
| Molecular Weight | 225.14 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 53.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 225.13649 |
| Heavy Atoms | 16 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 844882-34-4 |
|---|---|
| SMILES | CCC1=C(C=C(O1)C(=O)O)CN(CC)CC |
| InChIKey | MMXNBMVJYDEHTF-UHFFFAOYSA-N |
Product Overview
4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid (CAS 844882-34-4), with molecular formula C12H19NO3 and molecular weight 225.14 g/mol. IUPAC: 4-(diethylaminomethyl)-5-ethylfuran-2-carboxylic acid.
Chemical Property Profile of 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid
Property Insights of 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid. With a topological polar surface area (TPSA) of 53.7 Ų, 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(Diethylamino)methyl]-5-ethyl-2-furoic 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 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid?
The CAS number of 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid is 844882-34-4.
What is the molecular formula of 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid?
The molecular formula of 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid is C12H19NO3.
What is the molecular weight of 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid?
The molecular weight of 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid is 225.14 g/mol.
Where can I buy 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid?
You can request a quote for 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(Diethylamino)methyl]-5-ethyl-2-furoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.