6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)-
TL;DR: 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)- (CAS 69225-89-4) is a chemical compound with molecular formula C21H22O5 and molecular weight 354.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)benzo[c]chromene-9-carboxylic acid
Also Known As: Alcohols, C16-22, ethoxylated, 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)-, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)benzo[c]chromene-9-carboxylic acid, 1-Hydroxy-6,6-dimethyl-3-(3-oxopentyl)-6H-dibenzo[b,d]pyran-9-carboxylic acid, 6H-Dibenzo[b,d]pyran-9-carboxylicacid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)-
| Molecular Formula | C21H22O5 |
|---|---|
| Molecular Weight | 354.15 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 354.14673 |
| Heavy Atoms | 26 |
| Complexity | 543.0 |
Chemical Identifiers
| CAS Number | 69225-89-4 |
|---|---|
| SMILES | CCC(=O)CCC1=CC(=C2C(=C1)OC(C3=C2C=C(C=C3)C(=O)O)(C)C)O |
| InChIKey | CQXTYBZTKGMYOJ-UHFFFAOYSA-N |
Product Overview
6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)- (CAS 69225-89-4), with molecular formula C21H22O5 and molecular weight 354.15 g/mol. IUPAC: 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)benzo[c]chromene-9-carboxylic acid.
Chemical Property Profile of 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)-
Property Insights of 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)-
The XLogP value of 3.2 indicates that 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)-. Following Lipinski's Rule of Five, 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)- has 2 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 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)-?
The CAS number of 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)- is 69225-89-4.
What is the molecular formula of 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)-?
The molecular formula of 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)- is C21H22O5.
What is the molecular weight of 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)-?
The molecular weight of 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)- is 354.15 g/mol.
Where can I buy 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)-?
You can request a quote for 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)-?
Yes, KEHONG BIO provides custom synthesis services for 6H-Dibenzo(b,d)pyran-9-carboxylic acid, 1-hydroxy-6,6-dimethyl-3-(3-oxopentyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.