Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]-
TL;DR: Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]- (CAS 130471-75-9) is a chemical compound with molecular formula C15H12O5 and molecular weight 272.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-acetyl-3,5-dihydroxyphenyl) benzoate
Also Known As: 4-O-benzoylphloracetophenone, 4-acetyl-3,5-dihydroxyphenyl benzoate, (4-acetyl-3,5-dihydroxyphenyl) benzoate, Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]-, (4-acetyl-3,5-dihydroxy-phenyl) Benzoate
| Molecular Formula | C15H12O5 |
|---|---|
| Molecular Weight | 272.07 g/mol |
| LogP | 2.5196 |
| Topological Polar Surface Area | 83.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.06848 |
| Heavy Atoms | 20 |
| Complexity | 638.2141 |
Chemical Identifiers
| CAS Number | 130471-75-9 |
|---|---|
| SMILES | CC(=O)C1=C(C=C(C=C1O)OC(=O)C2=CC=CC=C2)O |
Product Overview
Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]- (CAS 130471-75-9), with molecular formula C15H12O5 and molecular weight 272.07 g/mol. IUPAC: (4-acetyl-3,5-dihydroxyphenyl) benzoate.
Chemical Property Profile of Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]-
Property Insights of Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]-
The XLogP value of 2.5196 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]-. The TPSA of 83.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]-. Following Lipinski's Rule of Five, Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]- 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 Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]-?
The CAS number of Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]- is 130471-75-9.
What is the molecular formula of Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]-?
The molecular formula of Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]- is C15H12O5.
What is the molecular weight of Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]-?
The molecular weight of Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]- is 272.07 g/mol.
Where can I buy Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]-?
You can request a quote for Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-[4-(benzoyloxy)-2,6-dihydroxyphenyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.