Pentane-2,4-dione, 3-(4-methoxybenzoyl)-
TL;DR: Pentane-2,4-dione, 3-(4-methoxybenzoyl)- (CAS 137833-36-4) is a chemical compound with molecular formula C13H14O4 and molecular weight 234.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methoxybenzoyl)pentane-2,4-dione
Also Known As: Pentane-2,4-dione, 3-(4-methoxybenzoyl)-, 3-(4-methoxybenzoyl)pentane-2,4-dione, Pentane-2,4-dione,3- -, 3-(p-Anisoyl)-2,4-pentanedione, Pentane-2,4-dione,3-(4-methoxybenzoyl)
| Molecular Formula | C13H14O4 |
|---|---|
| Molecular Weight | 234.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 234.0892 |
| Heavy Atoms | 17 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 137833-36-4 |
|---|---|
| SMILES | CC(=O)C(C(=O)C)C(=O)C1=CC=C(C=C1)OC |
| InChIKey | CRQNKYNTSKUTDE-UHFFFAOYSA-N |
Product Overview
Pentane-2,4-dione, 3-(4-methoxybenzoyl)- (CAS 137833-36-4), with molecular formula C13H14O4 and molecular weight 234.09 g/mol. IUPAC: 3-(4-methoxybenzoyl)pentane-2,4-dione.
Chemical Property Profile of Pentane-2,4-dione, 3-(4-methoxybenzoyl)-
Property Insights of Pentane-2,4-dione, 3-(4-methoxybenzoyl)-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentane-2,4-dione, 3-(4-methoxybenzoyl)-. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Pentane-2,4-dione, 3-(4-methoxybenzoyl)-. Following Lipinski's Rule of Five, Pentane-2,4-dione, 3-(4-methoxybenzoyl)- has 0 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 Pentane-2,4-dione, 3-(4-methoxybenzoyl)-?
The CAS number of Pentane-2,4-dione, 3-(4-methoxybenzoyl)- is 137833-36-4.
What is the molecular formula of Pentane-2,4-dione, 3-(4-methoxybenzoyl)-?
The molecular formula of Pentane-2,4-dione, 3-(4-methoxybenzoyl)- is C13H14O4.
What is the molecular weight of Pentane-2,4-dione, 3-(4-methoxybenzoyl)-?
The molecular weight of Pentane-2,4-dione, 3-(4-methoxybenzoyl)- is 234.09 g/mol.
Where can I buy Pentane-2,4-dione, 3-(4-methoxybenzoyl)-?
You can request a quote for Pentane-2,4-dione, 3-(4-methoxybenzoyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentane-2,4-dione, 3-(4-methoxybenzoyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pentane-2,4-dione, 3-(4-methoxybenzoyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.