TL;DR: 4-(3-Bromobenzoyl)morpholine (CAS 153435-81-5) is a chemical compound with molecular formula C11H12BrNO2 and molecular weight 269.00513 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-bromophenyl)-morpholin-4-ylmethanone
Also Known As: 4-(3-Bromobenzoyl)morpholine, (3-Bromophenyl)(morpholino)methanone, 4-(3-BROMOBENZOYL) MORPHOLINE, (3-bromophenyl)-morpholin-4-ylmethanone, 3-Bromobenzoic acid, morpholide
| Molecular Formula | C11H12BrNO2 |
| Molecular Weight | 269.00513 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 269.00513 Da |
| Heavy Atoms | 15 |
| Complexity | 229.0 |
| SMILES | C1COCCN1C(=O)C2=CC(=CC=C2)Br |
| InChIKey | ZVHMYYPSUJGLHH-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3-Bromobenzoyl)morpholine. With a topological polar surface area (TPSA) of 29.5 Ų, 4-(3-Bromobenzoyl)morpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3-Bromobenzoyl)morpholine 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 4-(3-Bromobenzoyl)morpholine is 153435-81-5.
The molecular formula of 4-(3-Bromobenzoyl)morpholine is C11H12BrNO2.
The molecular weight of 4-(3-Bromobenzoyl)morpholine is 269.00513 g/mol.
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