4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione
TL;DR: 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione (CAS 1500-94-3) is a chemical compound with molecular formula C9H6O4 and molecular weight 178.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-2-benzofuran-1,3-dione
Also Known As: 4-METHOXYISOBENZOFURAN-1,3-DIONE, 4-methoxy-2-benzofuran-1,3-dione, 3-methoxyphthalic anhydride, 4-Methoxy-1,3-isobenzofurandione, o-methoxyphthalic anhydride
| Molecular Formula | C9H6O4 |
|---|---|
| Molecular Weight | 178.03 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 178.02661 |
| Heavy Atoms | 13 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 1500-94-3 |
|---|---|
| SMILES | COC1=CC=CC2=C1C(=O)OC2=O |
| InChIKey | KRKJKLCCCGDNCY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione (CAS 1500-94-3), with molecular formula C9H6O4 and molecular weight 178.03 g/mol. IUPAC: 4-methoxy-2-benzofuran-1,3-dione.
Chemical Property Profile of 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione
Property Insights of 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione. With a topological polar surface area (TPSA) of 52.6 Ų, 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione 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 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione?
The CAS number of 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione is 1500-94-3.
What is the molecular formula of 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione?
The molecular formula of 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione is C9H6O4.
What is the molecular weight of 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione?
The molecular weight of 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione is 178.03 g/mol.
Where can I buy 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione?
You can request a quote for 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-1,3-dihydro-2-benzofuran-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.