Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris-
TL;DR: Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris- (CAS 89725-66-6) is a chemical compound with molecular formula C12H12O3 and molecular weight 204.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-diacetylphenyl)ethanone
Also Known As: 1,2,4-Triacetylbenzol, 1,2,4-TRIACETYLBENZENE, 1-(3,4-diacetylphenyl)ethanone, 1-(2,4-diacetylphenyl)ethanone, 1-(2,4-diacetylphenyl)ethan-1-one
| Molecular Formula | C12H12O3 |
|---|---|
| Molecular Weight | 204.08 g/mol |
| LogP | 2.2944 |
| Topological Polar Surface Area | 51.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.07864 |
| Heavy Atoms | 15 |
| Complexity | 444.18048 |
Chemical Identifiers
| CAS Number | 89725-66-6 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C=C1)C(=O)C)C(=O)C |
Product Overview
Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris- (CAS 89725-66-6), with molecular formula C12H12O3 and molecular weight 204.08 g/mol. IUPAC: 1-(3,4-diacetylphenyl)ethanone.
Chemical Property Profile of Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris-
Property Insights of Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris-
The XLogP value of 2.2944 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris-. With a topological polar surface area (TPSA) of 51.21 Ų, Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris- has 0 hydrogen bond donor(s) and 3 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, 1,1',1''-(1,2,4-benzenetriyl)tris-?
The CAS number of Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris- is 89725-66-6.
What is the molecular formula of Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris-?
The molecular formula of Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris- is C12H12O3.
What is the molecular weight of Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris-?
The molecular weight of Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris- is 204.08 g/mol.
Where can I buy Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris-?
You can request a quote for Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1,1',1''-(1,2,4-benzenetriyl)tris- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.