3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1)
TL;DR: 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1) (CAS 67953-40-6) is a chemical compound with molecular formula C13H14O7 and molecular weight 282.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzofuran-1,3-dione;3-hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid
Also Known As: (C8-H4-O3.C5-H10-O4)x-, Dimethylolpropionic acid, phthalic anhydride resin, Propanoic acid, 3-hydroxy-2-(hydroxymethyl)-2-methyl-, polymer with 1,3-isobenzofurandione, 2-benzofuran-1,3-dione; 3-hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid, 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1)
| Molecular Formula | C13H14O7 |
|---|---|
| Molecular Weight | 282.07 g/mol |
| LogP | 0.0591 |
| Topological Polar Surface Area | 121.13 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.07394 |
| Heavy Atoms | 20 |
| Complexity | 498.27615 |
Chemical Identifiers
| CAS Number | 67953-40-6 |
|---|---|
| SMILES | CC(CO)(CO)C(=O)O.C1=CC=C2C(=C1)C(=O)OC2=O |
Product Overview
3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1) (CAS 67953-40-6), with molecular formula C13H14O7 and molecular weight 282.07 g/mol. IUPAC: 2-benzofuran-1,3-dione;3-hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid.
Chemical Property Profile of 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1)
Property Insights of 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1)
The XLogP value of 0.0591 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1). The TPSA of 121.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1). Following Lipinski's Rule of Five, 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1) has 3 hydrogen bond donor(s) and 6 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 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1)?
The CAS number of 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1) is 67953-40-6.
What is the molecular formula of 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1)?
The molecular formula of 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1) is C13H14O7.
What is the molecular weight of 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1)?
The molecular weight of 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1) is 282.07 g/mol.
Where can I buy 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1)?
You can request a quote for 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--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 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid--2-benzofuran-1,3-dione (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.