1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone
TL;DR: 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone (CAS 437-72-9) is a chemical compound with molecular formula C11H14O4 and molecular weight 210.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dihydroxy-4-methoxyphenyl)butan-1-one
Also Known As: Desapidinol, Desaspidinol, 1-(2,6-dihydroxy-4-methoxyphenyl)butan-1-one, 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone, J2.376.987E
| Molecular Formula | C11H14O4 |
|---|---|
| Molecular Weight | 210.09 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 210.0892 |
| Heavy Atoms | 15 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 437-72-9 |
|---|---|
| SMILES | CCCC(=O)C1=C(C=C(C=C1O)OC)O |
| InChIKey | SIAXRISTUAUQAK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone (CAS 437-72-9), with molecular formula C11H14O4 and molecular weight 210.09 g/mol. IUPAC: 1-(2,6-dihydroxy-4-methoxyphenyl)butan-1-one.
Chemical Property Profile of 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone
Property Insights of 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone. Following Lipinski's Rule of Five, 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone has 2 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-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone?
The CAS number of 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone is 437-72-9.
What is the molecular formula of 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone?
The molecular formula of 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone is C11H14O4.
What is the molecular weight of 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone?
The molecular weight of 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone is 210.09 g/mol.
Where can I buy 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone?
You can request a quote for 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,6-Dihydroxy-4-methoxyphenyl)-1-butanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.