2-Benzofuran-1,3-dione--propane-1,3-diol (1/1)
TL;DR: 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1) (CAS 68155-85-1) is a chemical compound with molecular formula C11H12O5 and molecular weight 224.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzofuran-1,3-dione;propane-1,3-diol
Also Known As: (C8-H4-O3.C3-H8-O2)x-, 2-benzofuran-1,3-dione; propane-1,3-diol, isobenzofuran-1,3-dione; propane-1,3-diol, Phthalic anhydride, 1,3-propylene glycol polymer, 1,3-Isobenzofurandione, polymer with 1,3-propanediol
| Molecular Formula | C11H12O5 |
|---|---|
| Molecular Weight | 224.07 g/mol |
| LogP | 0.3583 |
| Topological Polar Surface Area | 83.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.06847 |
| Heavy Atoms | 16 |
| Complexity | 350.71625 |
Chemical Identifiers
| CAS Number | 68155-85-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)OC2=O.C(CO)CO |
Product Overview
2-Benzofuran-1,3-dione--propane-1,3-diol (1/1) (CAS 68155-85-1), with molecular formula C11H12O5 and molecular weight 224.07 g/mol. IUPAC: 2-benzofuran-1,3-dione;propane-1,3-diol.
Chemical Property Profile of 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1)
Property Insights of 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1)
The XLogP value of 0.3583 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1). The TPSA of 83.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1). Following Lipinski's Rule of Five, 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1) has 2 hydrogen bond donor(s) and 5 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-Benzofuran-1,3-dione--propane-1,3-diol (1/1)?
The CAS number of 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1) is 68155-85-1.
What is the molecular formula of 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1)?
The molecular formula of 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1) is C11H12O5.
What is the molecular weight of 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1)?
The molecular weight of 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1) is 224.07 g/mol.
Where can I buy 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1)?
You can request a quote for 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzofuran-1,3-dione--propane-1,3-diol (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.