Dimethyl Cromoglicate
TL;DR: Dimethyl Cromoglicate (CAS 51471-26-2) is a chemical compound with molecular formula C25H20O11 and molecular weight 496.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[2-hydroxy-3-(2-methoxycarbonyl-4-oxochromen-5-yl)oxypropoxy]-4-oxochromene-2-carboxylate
Also Known As: Dimethyl Cromoglicate, EINECS 257-223-3, Sodium Cromoglicate Impurity 21, Dimethyl 5,5'-((2-hydroxytrimethylene)bis(oxy))bis(4-oxo-4H-1-benzopyran-2-carboxylate), methyl 5-[2-hydroxy-3-(2-methoxycarbonyl-4-oxochromen-5-yl)oxypropoxy]-4-oxochromene-2-carboxylate
| Molecular Formula | C25H20O11 |
|---|---|
| Molecular Weight | 496.10 g/mol |
| LogP | 2.2913 |
| Topological Polar Surface Area | 151.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 496.10056 |
| Heavy Atoms | 36 |
| Complexity | 1447.114 |
Chemical Identifiers
| CAS Number | 51471-26-2 |
|---|---|
| SMILES | COC(=O)C1=CC(=O)C2=C(O1)C=CC=C2OCC(COC3=CC=CC4=C3C(=O)C=C(O4)C(=O)OC)O |
Product Overview
Dimethyl Cromoglicate (CAS 51471-26-2), with molecular formula C25H20O11 and molecular weight 496.10 g/mol. IUPAC: methyl 5-[2-hydroxy-3-(2-methoxycarbonyl-4-oxochromen-5-yl)oxypropoxy]-4-oxochromene-2-carboxylate.
Chemical Property Profile of Dimethyl Cromoglicate
Property Insights of Dimethyl Cromoglicate
The XLogP value of 2.2913 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl Cromoglicate. The TPSA of 151.71 Ų indicates high polarity, suggesting Dimethyl Cromoglicate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dimethyl Cromoglicate has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dimethyl Cromoglicate?
The CAS number of Dimethyl Cromoglicate is 51471-26-2.
What is the molecular formula of Dimethyl Cromoglicate?
The molecular formula of Dimethyl Cromoglicate is C25H20O11.
What is the molecular weight of Dimethyl Cromoglicate?
The molecular weight of Dimethyl Cromoglicate is 496.10 g/mol.
Where can I buy Dimethyl Cromoglicate?
You can request a quote for Dimethyl Cromoglicate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl Cromoglicate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl Cromoglicate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.