TL;DR: 4-(2-Chloro-5-nitrobenzoyl)morpholine (CAS 142439-65-4) is a chemical compound with molecular formula C11H11ClN2O4 and molecular weight 270.04074 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-chloro-5-nitrophenyl)-morpholin-4-ylmethanone
Also Known As: 4-(2-chloro-5-nitrobenzoyl)morpholine, (2-Chloro-5-nitrophenyl)(morpholino)methanone, Morpholine, 4-(2-chloro-5-nitrobenzoyl)-, (2-chloro-5-nitrophenyl)-morpholin-4-ylmethanone, 2-chloro-5-nitrophenyl morpholin-4-yl ketone
| Molecular Formula | C11H11ClN2O4 |
| Molecular Weight | 270.04074 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 75.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 270.04074 Da |
| Heavy Atoms | 18 |
| Complexity | 327.0 |
| SMILES | C1COCCN1C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl |
| InChIKey | KFAOBRKSOXRWLJ-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Chloro-5-nitrobenzoyl)morpholine. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Chloro-5-nitrobenzoyl)morpholine. Following Lipinski's Rule of Five, 4-(2-Chloro-5-nitrobenzoyl)morpholine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(2-Chloro-5-nitrobenzoyl)morpholine is 142439-65-4.
The molecular formula of 4-(2-Chloro-5-nitrobenzoyl)morpholine is C11H11ClN2O4.
The molecular weight of 4-(2-Chloro-5-nitrobenzoyl)morpholine is 270.04074 g/mol.
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