2-Hydroxy-7-hydroxymethylchromene-2-carboxylate
TL;DR: 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate (CAS 156605-24-2) is a chemical compound with molecular formula C11H10O5 and molecular weight 222.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-7-(hydroxymethyl)chromene-2-carboxylic acid
Also Known As: 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate, 2-hydroxy-7-(hydroxymethyl)chromene-2-carboxylic acid, J2.787.878D, 2-Hydroxy-7-hydroxymethylchromene-2-carboxylic acid, 2-Hydroxy-7-(hydroxymethyl)-2H-1-benzopyran-2-carboxylic acid
| Molecular Formula | C11H10O5 |
|---|---|
| Molecular Weight | 222.05 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.05283 |
| Heavy Atoms | 16 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 156605-24-2 |
|---|---|
| SMILES | C1=CC(=CC2=C1C=CC(O2)(C(=O)O)O)CO |
| InChIKey | RAPNWMUVBAAVEA-UHFFFAOYSA-N |
Product Overview
2-Hydroxy-7-hydroxymethylchromene-2-carboxylate (CAS 156605-24-2), with molecular formula C11H10O5 and molecular weight 222.05 g/mol. IUPAC: 2-hydroxy-7-(hydroxymethyl)chromene-2-carboxylic acid.
Chemical Property Profile of 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate
Property Insights of 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate. Following Lipinski's Rule of Five, 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate has 3 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-Hydroxy-7-hydroxymethylchromene-2-carboxylate?
The CAS number of 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate is 156605-24-2.
What is the molecular formula of 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate?
The molecular formula of 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate is C11H10O5.
What is the molecular weight of 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate?
The molecular weight of 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate is 222.05 g/mol.
Where can I buy 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate?
You can request a quote for 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.