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Naphtho[2,1-b]furan-2-carboxylic acid
TL;DR: Naphtho[2,1-b]furan-2-carboxylic acid (CAS 5656-67-7) is a chemical compound with molecular formula C13H8O3 and molecular weight 212.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzo[e][1]benzofuran-2-carboxylic acid
Also Known As: naphtho[2,1-b]furan-2-carboxylic acid, 4-allythiophenol, benzo[e][1]benzofuran-2-carboxylic acid, benzo[e]benzofuran-2-carboxylic acid, naphtho2,1-bfuran-2-carboxylic Acid
| Molecular Formula | C13H8O3 |
|---|---|
| Molecular Weight | 212.05 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 212.04735 |
| Heavy Atoms | 16 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 5656-67-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C=C(O3)C(=O)O |
| InChIKey | QVRZMUFOHNANGY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Naphtho[2,1-b]furan-2-carboxylic acid (CAS 5656-67-7), with molecular formula C13H8O3 and molecular weight 212.05 g/mol. IUPAC: benzo[e][1]benzofuran-2-carboxylic acid.
Chemical Property Profile of Naphtho[2,1-b]furan-2-carboxylic acid
Property Insights of Naphtho[2,1-b]furan-2-carboxylic acid
The XLogP value of 3.7 indicates that Naphtho[2,1-b]furan-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.4 Ų, Naphtho[2,1-b]furan-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphtho[2,1-b]furan-2-carboxylic acid has 1 hydrogen bond donor(s) and 3 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 Naphtho[2,1-b]furan-2-carboxylic acid?
The CAS number of Naphtho[2,1-b]furan-2-carboxylic acid is 5656-67-7.
What is the molecular formula of Naphtho[2,1-b]furan-2-carboxylic acid?
The molecular formula of Naphtho[2,1-b]furan-2-carboxylic acid is C13H8O3.
What is the molecular weight of Naphtho[2,1-b]furan-2-carboxylic acid?
The molecular weight of Naphtho[2,1-b]furan-2-carboxylic acid is 212.05 g/mol.
Where can I buy Naphtho[2,1-b]furan-2-carboxylic acid?
You can request a quote for Naphtho[2,1-b]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 Naphtho[2,1-b]furan-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for Naphtho[2,1-b]furan-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.