2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid
TL;DR: 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid (CAS 501918-27-0) is a chemical compound with molecular formula C13H16O4 and molecular weight 236.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]propanoic acid
Also Known As: 2-(2,2-DIMETHYL-2,3-DIHYDRO-BENZOFURAN-7-YLOXY)-PROPIONIC ACID, 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]propanoic acid, 2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]propanoic acid
| Molecular Formula | C13H16O4 |
|---|---|
| Molecular Weight | 236.10 g/mol |
| LogP | 2.252 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.10486 |
| Heavy Atoms | 17 |
| Complexity | 450.73273 |
Chemical Identifiers
| CAS Number | 501918-27-0 |
|---|---|
| SMILES | CC(C(=O)O)OC1=CC=CC2=C1OC(C2)(C)C |
Product Overview
2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid (CAS 501918-27-0), with molecular formula C13H16O4 and molecular weight 236.10 g/mol. IUPAC: 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]propanoic acid.
Chemical Property Profile of 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid
Property Insights of 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid
The XLogP value of 2.252 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid. With a topological polar surface area (TPSA) of 55.76 Ų, 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic 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 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid?
The CAS number of 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid is 501918-27-0.
What is the molecular formula of 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid?
The molecular formula of 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid is C13H16O4.
What is the molecular weight of 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid?
The molecular weight of 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid is 236.10 g/mol.
Where can I buy 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid?
You can request a quote for 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yloxy)-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.