3-(5-methyl-2-furyl)benzoic Acid
TL;DR: 3-(5-methyl-2-furyl)benzoic Acid (CAS 400746-01-2) is a chemical compound with molecular formula C12H10O3 and molecular weight 202.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-methylfuran-2-yl)benzoic acid
Also Known As: 3-(5-methyl-2-furyl)benzoic Acid, 3-(5-methylfuran-2-yl)benzoic acid, 3-(5-Methyl-furan-2-yl)-benzoic acid, 3-(5-methylfuran-2-yl)benzoicacid, BB 0224080
| Molecular Formula | C12H10O3 |
|---|---|
| Molecular Weight | 202.06 g/mol |
| LogP | 2.95322 |
| Topological Polar Surface Area | 50.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.06299 |
| Heavy Atoms | 15 |
| Complexity | 497.07327 |
Chemical Identifiers
| CAS Number | 400746-01-2 |
|---|---|
| SMILES | CC1=CC=C(O1)C2=CC(=CC=C2)C(=O)O |
Product Overview
3-(5-methyl-2-furyl)benzoic Acid (CAS 400746-01-2), with molecular formula C12H10O3 and molecular weight 202.06 g/mol. IUPAC: 3-(5-methylfuran-2-yl)benzoic acid.
Chemical Property Profile of 3-(5-methyl-2-furyl)benzoic Acid
Property Insights of 3-(5-methyl-2-furyl)benzoic Acid
The XLogP value of 2.95322 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-methyl-2-furyl)benzoic Acid. With a topological polar surface area (TPSA) of 50.44 Ų, 3-(5-methyl-2-furyl)benzoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(5-methyl-2-furyl)benzoic Acid has 1 hydrogen bond donor(s) and 2 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 3-(5-methyl-2-furyl)benzoic Acid?
The CAS number of 3-(5-methyl-2-furyl)benzoic Acid is 400746-01-2.
What is the molecular formula of 3-(5-methyl-2-furyl)benzoic Acid?
The molecular formula of 3-(5-methyl-2-furyl)benzoic Acid is C12H10O3.
What is the molecular weight of 3-(5-methyl-2-furyl)benzoic Acid?
The molecular weight of 3-(5-methyl-2-furyl)benzoic Acid is 202.06 g/mol.
Where can I buy 3-(5-methyl-2-furyl)benzoic Acid?
You can request a quote for 3-(5-methyl-2-furyl)benzoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-methyl-2-furyl)benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-methyl-2-furyl)benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.