2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1)
TL;DR: 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1) (CAS 68389-56-0) is a chemical compound with molecular formula C20H28O7 and molecular weight 380.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzofuran-1,3-dione;2,3-dihydroxypropyl nonanoate
Also Known As: 1,3-Isobenzofurandione, polymer with 1,2,3-propanetriol, nonanoate, 2-benzofuran-1,3-dione; 2,3-dihydroxypropyl nonanoate, 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1)
| Molecular Formula | C20H28O7 |
|---|---|
| Molecular Weight | 380.18 g/mol |
| LogP | 2.6306 |
| Topological Polar Surface Area | 110.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 380.1835 |
| Heavy Atoms | 27 |
| Complexity | 579.1027 |
Chemical Identifiers
| CAS Number | 68389-56-0 |
|---|---|
| SMILES | CCCCCCCCC(=O)OCC(CO)O.C1=CC=C2C(=C1)C(=O)OC2=O |
Product Overview
2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1) (CAS 68389-56-0), with molecular formula C20H28O7 and molecular weight 380.18 g/mol. IUPAC: 2-benzofuran-1,3-dione;2,3-dihydroxypropyl nonanoate.
Chemical Property Profile of 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1)
Property Insights of 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1)
The XLogP value of 2.6306 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1). The TPSA of 110.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1). Following Lipinski's Rule of Five, 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1) has 2 hydrogen bond donor(s) and 7 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 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1)?
The CAS number of 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1) is 68389-56-0.
What is the molecular formula of 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1)?
The molecular formula of 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1) is C20H28O7.
What is the molecular weight of 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1)?
The molecular weight of 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1) is 380.18 g/mol.
Where can I buy 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1)?
You can request a quote for 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dihydroxypropyl nonanoate--2-benzofuran-1,3-dione (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.