Butyrophenone, 2',4',6'-trihydroxy-3'-methyl-
TL;DR: Butyrophenone, 2',4',6'-trihydroxy-3'-methyl- (CAS 1509-06-4) 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-(2,4,6-trihydroxy-3-methylphenyl)butan-1-one
Also Known As: Methylphlorbutyrophenone, Butyryl-3-methylphloroglucinol, 1-(2,4,6-trihydroxy-3-methylphenyl)butan-1-one, Butyrophenone, 2',4',6'-trihydroxy-3'-methyl-, 2-Butyryl-4-methylphloroglucinol
| Molecular Formula | C11H14O4 |
|---|---|
| Molecular Weight | 210.09 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 210.0892 |
| Heavy Atoms | 15 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 1509-06-4 |
|---|---|
| SMILES | CCCC(=O)C1=C(C=C(C(=C1O)C)O)O |
| InChIKey | WPBGSQXSWBAQEX-UHFFFAOYSA-N |
Product Overview
Butyrophenone, 2',4',6'-trihydroxy-3'-methyl- (CAS 1509-06-4), with molecular formula C11H14O4 and molecular weight 210.09 g/mol. IUPAC: 1-(2,4,6-trihydroxy-3-methylphenyl)butan-1-one.
Chemical Property Profile of Butyrophenone, 2',4',6'-trihydroxy-3'-methyl-
Property Insights of Butyrophenone, 2',4',6'-trihydroxy-3'-methyl-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyrophenone, 2',4',6'-trihydroxy-3'-methyl-. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyrophenone, 2',4',6'-trihydroxy-3'-methyl-. Following Lipinski's Rule of Five, Butyrophenone, 2',4',6'-trihydroxy-3'-methyl- 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 Butyrophenone, 2',4',6'-trihydroxy-3'-methyl-?
The CAS number of Butyrophenone, 2',4',6'-trihydroxy-3'-methyl- is 1509-06-4.
What is the molecular formula of Butyrophenone, 2',4',6'-trihydroxy-3'-methyl-?
The molecular formula of Butyrophenone, 2',4',6'-trihydroxy-3'-methyl- is C11H14O4.
What is the molecular weight of Butyrophenone, 2',4',6'-trihydroxy-3'-methyl-?
The molecular weight of Butyrophenone, 2',4',6'-trihydroxy-3'-methyl- is 210.09 g/mol.
Where can I buy Butyrophenone, 2',4',6'-trihydroxy-3'-methyl-?
You can request a quote for Butyrophenone, 2',4',6'-trihydroxy-3'-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyrophenone, 2',4',6'-trihydroxy-3'-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Butyrophenone, 2',4',6'-trihydroxy-3'-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.