5-propoxy-3H-1-benzofuran-2-one
TL;DR: 5-propoxy-3H-1-benzofuran-2-one (CAS 742079-75-0) is a chemical compound with molecular formula C11H12O3 and molecular weight 192.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-propoxy-3H-1-benzofuran-2-one
Also Known As: 2(3H)-Benzofuranone, 5-propoxy-, 5-propoxy-3H-benzofuran-2-one
| Molecular Formula | C11H12O3 |
|---|---|
| Molecular Weight | 192.08 g/mol |
| LogP | 1.9369 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.07864 |
| Heavy Atoms | 14 |
| Complexity | 357.55032 |
Chemical Identifiers
| CAS Number | 742079-75-0 |
|---|---|
| SMILES | CCCOC1=CC2=C(C=C1)OC(=O)C2 |
Product Overview
5-propoxy-3H-1-benzofuran-2-one (CAS 742079-75-0), with molecular formula C11H12O3 and molecular weight 192.08 g/mol. IUPAC: 5-propoxy-3H-1-benzofuran-2-one.
Chemical Property Profile of 5-propoxy-3H-1-benzofuran-2-one
Property Insights of 5-propoxy-3H-1-benzofuran-2-one
The XLogP value of 1.9369 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-propoxy-3H-1-benzofuran-2-one. With a topological polar surface area (TPSA) of 35.53 Ų, 5-propoxy-3H-1-benzofuran-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-propoxy-3H-1-benzofuran-2-one has 0 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 5-propoxy-3H-1-benzofuran-2-one?
The CAS number of 5-propoxy-3H-1-benzofuran-2-one is 742079-75-0.
What is the molecular formula of 5-propoxy-3H-1-benzofuran-2-one?
The molecular formula of 5-propoxy-3H-1-benzofuran-2-one is C11H12O3.
What is the molecular weight of 5-propoxy-3H-1-benzofuran-2-one?
The molecular weight of 5-propoxy-3H-1-benzofuran-2-one is 192.08 g/mol.
Where can I buy 5-propoxy-3H-1-benzofuran-2-one?
You can request a quote for 5-propoxy-3H-1-benzofuran-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-propoxy-3H-1-benzofuran-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-propoxy-3H-1-benzofuran-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.