6,8-dichloro-3-propionyl-2H-chromen-2-one
TL;DR: 6,8-dichloro-3-propionyl-2H-chromen-2-one (CAS 688774-57-4) is a chemical compound with molecular formula C12H8Cl2O3 and molecular weight 269.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,8-dichloro-3-propanoylchromen-2-one
Also Known As: 6,8-dichloro-3-propanoyl-2H-chromen-2-one, 6,8-dichloro-3-propanoylchromen-2-one, 6,8-dichloro-3-propionyl-2H-chromen-2-one, 6,8-dichloro-3-propanoyl-chromen-2-one, F0918-6720
| Molecular Formula | C12H8Cl2O3 |
|---|---|
| Molecular Weight | 269.99 g/mol |
| LogP | 3.6925 |
| Topological Polar Surface Area | 47.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 269.98505 |
| Heavy Atoms | 17 |
| Complexity | 658.5837 |
Chemical Identifiers
| CAS Number | 688774-57-4 |
|---|---|
| SMILES | CCC(=O)C1=CC2=CC(=CC(=C2OC1=O)Cl)Cl |
Product Overview
6,8-dichloro-3-propionyl-2H-chromen-2-one (CAS 688774-57-4), with molecular formula C12H8Cl2O3 and molecular weight 269.99 g/mol. IUPAC: 6,8-dichloro-3-propanoylchromen-2-one.
Chemical Property Profile of 6,8-dichloro-3-propionyl-2H-chromen-2-one
Property Insights of 6,8-dichloro-3-propionyl-2H-chromen-2-one
The XLogP value of 3.6925 indicates that 6,8-dichloro-3-propionyl-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 47.28 Ų, 6,8-dichloro-3-propionyl-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,8-dichloro-3-propionyl-2H-chromen-2-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 6,8-dichloro-3-propionyl-2H-chromen-2-one?
The CAS number of 6,8-dichloro-3-propionyl-2H-chromen-2-one is 688774-57-4.
What is the molecular formula of 6,8-dichloro-3-propionyl-2H-chromen-2-one?
The molecular formula of 6,8-dichloro-3-propionyl-2H-chromen-2-one is C12H8Cl2O3.
What is the molecular weight of 6,8-dichloro-3-propionyl-2H-chromen-2-one?
The molecular weight of 6,8-dichloro-3-propionyl-2H-chromen-2-one is 269.99 g/mol.
Where can I buy 6,8-dichloro-3-propionyl-2H-chromen-2-one?
You can request a quote for 6,8-dichloro-3-propionyl-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,8-dichloro-3-propionyl-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6,8-dichloro-3-propionyl-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.