2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester
TL;DR: 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester (CAS 920286-80-2) is a chemical compound with molecular formula C12H17NO3 and molecular weight 223.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(pyrrolidin-1-ylmethyl)furan-2-carboxylate
Also Known As: 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester, Ethyl 5-(pyrrolidin-1-ylmethyl)furan-2-carboxylate, 5-pyrrolidine-1-yl-methyl-furan-2-carboxylic acid ethyl ester, Ethyl 5-[(pyrrolidin-1-yl)methyl]furan-2-carboxylate, 5-Pyrrolidin-1-ylmethyl-furan-2-carboxylic acid ethyl ester
| Molecular Formula | C12H17NO3 |
|---|---|
| Molecular Weight | 223.12 g/mol |
| LogP | 2.0521 |
| Topological Polar Surface Area | 42.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 223.12085 |
| Heavy Atoms | 16 |
| Complexity | 352.9008 |
Chemical Identifiers
| CAS Number | 920286-80-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(O1)CN2CCCC2 |
Product Overview
2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester (CAS 920286-80-2), with molecular formula C12H17NO3 and molecular weight 223.12 g/mol. IUPAC: ethyl 5-(pyrrolidin-1-ylmethyl)furan-2-carboxylate.
Chemical Property Profile of 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester
Property Insights of 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester
The XLogP value of 2.0521 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester. With a topological polar surface area (TPSA) of 42.68 Ų, 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester has 0 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 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester?
The CAS number of 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester is 920286-80-2.
What is the molecular formula of 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester?
The molecular formula of 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester is C12H17NO3.
What is the molecular weight of 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester?
The molecular weight of 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester is 223.12 g/mol.
Where can I buy 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester?
You can request a quote for 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Furancarboxylic acid, 5-(1-pyrrolidinylmethyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.