1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1)
TL;DR: 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1) (CAS 63549-26-8) is a chemical compound with molecular formula C16H13ClO5 and molecular weight 320.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(7-hydroxy-3-methoxychromenylium-2-yl)benzene-1,3-diol chloride
Also Known As: 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride, 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1), 2-(2,4-Dihydroxyphenyl)-7-hydroxy-3-methoxy-1-oxonianaphthalene chloride, 4-(7-hydroxy-3-methoxychromenylium-2-yl)benzene-1,3-diol chloride, 2-(2,4-Dihydroxyphenyl)-7-hydroxy-3-methoxy-1-benzopyran-1-ium chloride
| Molecular Formula | C16H13ClO5 |
|---|---|
| Molecular Weight | 320.05 g/mol |
| LogP | 0.5103 |
| Topological Polar Surface Area | 81.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 320.04517 |
| Heavy Atoms | 22 |
| Complexity | 832.12427 |
Chemical Identifiers
| CAS Number | 63549-26-8 |
|---|---|
| SMILES | COC1=C([O+]=C2C=C(C=CC2=C1)O)C3=C(C=C(C=C3)O)O.[Cl-] |
Product Overview
1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1) (CAS 63549-26-8), with molecular formula C16H13ClO5 and molecular weight 320.05 g/mol. IUPAC: 4-(7-hydroxy-3-methoxychromenylium-2-yl)benzene-1,3-diol chloride.
Chemical Property Profile of 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1)
Property Insights of 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1)
The XLogP value of 0.5103 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1). The TPSA of 81.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1). Following Lipinski's Rule of Five, 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1) has 3 hydrogen bond donor(s) and 4 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 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1)?
The CAS number of 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1) is 63549-26-8.
What is the molecular formula of 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1)?
The molecular formula of 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1) is C16H13ClO5.
What is the molecular weight of 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1)?
The molecular weight of 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1) is 320.05 g/mol.
Where can I buy 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1)?
You can request a quote for 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzopyrylium, 2-(2,4-dihydroxyphenyl)-7-hydroxy-3-methoxy-, chloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.