![3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one structure](/static/products/332/332103-06-7.png)
3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one
TL;DR: 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one (CAS 332103-06-7) is a chemical compound with molecular formula C18H13ClO3 and molecular weight 312.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorobenzoyl)-2,6-dimethylchromen-4-one
Also Known As: BAS 01121870, 3-(2-chlorobenzoyl)-2,6-dimethylchromen-4-one, 3-(2-Chloro-benzoyl)-2,6-dimethyl-chromen-4-one, 3-(2-chlorobenzoyl)-2,6-dimethyl-4H-chromen-4-one, 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one
| Molecular Formula | C18H13ClO3 |
|---|---|
| Molecular Weight | 312.06 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.05533 |
| Heavy Atoms | 22 |
| Complexity | 510.0 |
Chemical Identifiers
| CAS Number | 332103-06-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OC(=C(C2=O)C(=O)C3=CC=CC=C3Cl)C |
| InChIKey | ZADPSGSOKDWVGI-UHFFFAOYSA-N |
Product Overview
3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one (CAS 332103-06-7), with molecular formula C18H13ClO3 and molecular weight 312.06 g/mol. IUPAC: 3-(2-chlorobenzoyl)-2,6-dimethylchromen-4-one.
Chemical Property Profile of 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one
Property Insights of 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one
The XLogP value of 4.5 indicates that 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-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, 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-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 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one?
The CAS number of 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one is 332103-06-7.
What is the molecular formula of 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one?
The molecular formula of 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one is C18H13ClO3.
What is the molecular weight of 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one?
The molecular weight of 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one is 312.06 g/mol.
Where can I buy 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one?
You can request a quote for 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-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 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2-chlorophenyl)carbonyl]-2,6-dimethyl-4H-chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.