![6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one structure](/static/products/159/159760-52-8.webp)
6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one
TL;DR: 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one (CAS 159760-52-8) is a chemical compound with molecular formula C18H11BrO3 and molecular weight 353.98917 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-bromo-3-[(E)-3-phenylprop-2-enoyl]chromen-2-one
Also Known As: 6-bromo-3-cinnamoyl-2H-chromen-2-one, 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one, 6-bromo-3-[(E)-3-phenylprop-2-enoyl]chromen-2-one, J3.033.847B, 6-bromo-3-(3-phenylprop-2-enoyl)chromen-2-one
Technical Specifications
| Molecular Formula | C18H11BrO3 |
| Molecular Weight | 353.98917 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 353.98917 Da |
| Heavy Atoms | 22 |
| Complexity | 502.0 |
| SMILES | C1=CC=C(C=C1)/C=C/C(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O |
| InChIKey | HMEIKRHCVLVHEA-SOFGYWHQSA-N |
Chemical Property Profile of 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one
Property Insights of 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one
The XLogP value of 4.6 indicates that 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-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 43.4 Ų, 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-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
What is the CAS number of 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one?
The CAS number of 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one is 159760-52-8.
What is the molecular formula of 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one?
The molecular formula of 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one is C18H11BrO3.
What is the molecular weight of 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one?
The molecular weight of 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one is 353.98917 g/mol.
Where can I buy 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one?
You can request a quote for 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one?
Yes, CoreyChem provides custom synthesis services for 6-bromo-3-[(2E)-3-phenylprop-2-enoyl]-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.