2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one
TL;DR: 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one (CAS 65542-24-7) is a chemical compound with molecular formula C18H14O3 and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzoyl-2,6-dimethylchromen-4-one
Also Known As: 3-Benzoyl-2,6-dimethyl-chromen-4-one, BAS 01121865, 3-benzoyl-2,6-dimethylchromen-4-one, 3-Benzoyl-2,6-dimethyl-4H-1-benzopyran-4-one, 2,6-dimethyl-3-(phenylcarbonyl)chromen-4-one
| Molecular Formula | C18H14O3 |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.0943 |
| Heavy Atoms | 21 |
| Complexity | 471.0 |
Chemical Identifiers
| CAS Number | 65542-24-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OC(=C(C2=O)C(=O)C3=CC=CC=C3)C |
| InChIKey | SAFBDXKIQUGGOD-UHFFFAOYSA-N |
Product Overview
2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one (CAS 65542-24-7), with molecular formula C18H14O3 and molecular weight 278.09 g/mol. IUPAC: 3-benzoyl-2,6-dimethylchromen-4-one.
Chemical Property Profile of 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one
Property Insights of 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one
The XLogP value of 3.8 indicates that 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one 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 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one?
The CAS number of 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one is 65542-24-7.
What is the molecular formula of 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one?
The molecular formula of 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one is C18H14O3.
What is the molecular weight of 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one?
The molecular weight of 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one is 278.09 g/mol.
Where can I buy 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one?
You can request a quote for 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dimethyl-3-(phenylcarbonyl)chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.