1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone
TL;DR: 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone (CAS 91143-73-6) is a chemical compound with molecular formula C11H12O4 and molecular weight 208.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-hydroxy-4-propanoylphenyl) acetate
Also Known As: 4'-Acetoxy-2'-hydroxypropiophenone, 3-Hydroxy-4-propanoylphenyl acetate, 3-Hydroxy-4-propionylphenyl acetate, (3-hydroxy-4-propanoylphenyl) acetate, 3-Hydroxy-4-propionylphenyl acetate #
| Molecular Formula | C11H12O4 |
|---|---|
| Molecular Weight | 208.07 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.07356 |
| Heavy Atoms | 15 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 91143-73-6 |
|---|---|
| SMILES | CCC(=O)C1=C(C=C(C=C1)OC(=O)C)O |
| InChIKey | ARNRYDMRKCMJJI-UHFFFAOYSA-N |
Product Overview
1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone (CAS 91143-73-6), with molecular formula C11H12O4 and molecular weight 208.07 g/mol. IUPAC: (3-hydroxy-4-propanoylphenyl) acetate.
Chemical Property Profile of 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone
Property Insights of 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone. Following Lipinski's Rule of Five, 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone has 1 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-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone?
The CAS number of 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone is 91143-73-6.
What is the molecular formula of 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone?
The molecular formula of 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone is C11H12O4.
What is the molecular weight of 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone?
The molecular weight of 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone is 208.07 g/mol.
Where can I buy 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone?
You can request a quote for 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-(Acetyloxy)-2-hydroxyphenyl)-1-propanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.