6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one
TL;DR: 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one (CAS 147054-01-1) is a chemical compound with molecular formula C12H10Cl2O2 and molecular weight 256.0058 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-chloro-4-(chloromethyl)-5,7-dimethylchromen-2-one
Also Known As: 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one, 6-chloro-4-(chloromethyl)-5,7-dimethylchromen-2-one, L-5373, F3055-0314
Technical Specifications
| Molecular Formula | C12H10Cl2O2 |
| Molecular Weight | 256.0058 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 256.0058 Da |
| Heavy Atoms | 16 |
| Complexity | 327.0 |
| SMILES | CC1=CC2=C(C(=C1Cl)C)C(=CC(=O)O2)CCl |
| InChIKey | FEPJUWJEMJYJCF-UHFFFAOYSA-N |
Chemical Property Profile of 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one
Property Insights of 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one
The XLogP value of 3.2 indicates that 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one?
The CAS number of 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one is 147054-01-1.
What is the molecular formula of 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one?
The molecular formula of 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one is C12H10Cl2O2.
What is the molecular weight of 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one?
The molecular weight of 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one is 256.0058 g/mol.
Where can I buy 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one?
You can request a quote for 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one?
Yes, CoreyChem provides custom synthesis services for 6-chloro-4-(chloromethyl)-5,7-dimethyl-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.