TL;DR: 3-(Oxoarsanyl)benzamide (CAS 102613-04-7) is a chemical compound with molecular formula C7H6AsNO2 and molecular weight 210.96144 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-arsorosobenzamide
Also Known As: m-Arsenosobenzamide, 3-(oxoarsanyl)benzamide, 3-arsorosobenzamide, Benzamide, m-arsenoso-, NIOSH/CV2342800
| Molecular Formula | C7H6AsNO2 |
| Molecular Weight | 210.96144 g/mol |
| XLogP | -0.5395 |
| Topological Polar Surface Area (TPSA) | 60.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.96144 Da |
| Heavy Atoms | 11 |
| Complexity | 172.0 |
| SMILES | C1=CC(=CC(=C1)[As]=O)C(=O)N |
| InChIKey | XGPRMBHKUXJUNK-UHFFFAOYSA-N |
The XLogP value of -0.5395 indicates that 3-(Oxoarsanyl)benzamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Oxoarsanyl)benzamide. Following Lipinski's Rule of Five, 3-(Oxoarsanyl)benzamide has 1 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 3-(Oxoarsanyl)benzamide is 102613-04-7.
The molecular formula of 3-(Oxoarsanyl)benzamide is C7H6AsNO2.
The molecular weight of 3-(Oxoarsanyl)benzamide is 210.96144 g/mol.
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