TL;DR: 6-Bromo-3,4-dihydro-4-phenyl-2H-1-benzopyran-2-one (CAS 156755-23-6) is a chemical compound with molecular formula C15H11BrO2 and molecular weight 301.99423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-bromo-4-phenyl-3,4-dihydrochromen-2-one
Also Known As: 6-bromo-4-phenylchroman-2-one, 6-Bromo-3,4-dihydro-4-phenyl-2H-1-Benzopyran-2-one, CHEMBRDG-BB 7041866, 6-Bromo-4-phenyl-2-chromanone, 6-bromo-4-phenyl-3,4-dihydrochromen-2-one
| Molecular Formula | C15H11BrO2 |
| Molecular Weight | 301.99423 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 301.99423 Da |
| Heavy Atoms | 18 |
| Complexity | 312.0 |
| SMILES | C1C(C2=C(C=CC(=C2)Br)OC1=O)C3=CC=CC=C3 |
| InChIKey | KFKFQGCDFMGUCH-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that 6-Bromo-3,4-dihydro-4-phenyl-2H-1-benzopyran-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-Bromo-3,4-dihydro-4-phenyl-2H-1-benzopyran-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromo-3,4-dihydro-4-phenyl-2H-1-benzopyran-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.
The CAS number of 6-Bromo-3,4-dihydro-4-phenyl-2H-1-benzopyran-2-one is 156755-23-6.
The molecular formula of 6-Bromo-3,4-dihydro-4-phenyl-2H-1-benzopyran-2-one is C15H11BrO2.
The molecular weight of 6-Bromo-3,4-dihydro-4-phenyl-2H-1-benzopyran-2-one is 301.99423 g/mol.
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