TL;DR: Arsine oxide, allylhydroxyphenyl- (CAS 21905-27-1) is a chemical compound with molecular formula C9H11AsO2 and molecular weight 225.9975 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
phenyl(prop-2-enyl)arsinic acid
Also Known As: Allyl phenyl arsinic acid, Allylhydroxyphenylarsine oxide, Allylphenylarsinic acid, phenyl(prop-2-enyl)arsinic acid, ARSINE OXIDE, ALLYLHYDROXYPHENYL-
| Molecular Formula | C9H11AsO2 |
| Molecular Weight | 225.9975 g/mol |
| XLogP | 0.94 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 225.9975 Da |
| Heavy Atoms | 12 |
| Complexity | 195.0 |
| SMILES | C=CC[As](=O)(C1=CC=CC=C1)O |
| InChIKey | KNZSNYJBQFTWDN-UHFFFAOYSA-N |
The XLogP value of 0.94 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Arsine oxide, allylhydroxyphenyl-. With a topological polar surface area (TPSA) of 37.3 Ų, Arsine oxide, allylhydroxyphenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Arsine oxide, allylhydroxyphenyl- 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 Arsine oxide, allylhydroxyphenyl- is 21905-27-1.
The molecular formula of Arsine oxide, allylhydroxyphenyl- is C9H11AsO2.
The molecular weight of Arsine oxide, allylhydroxyphenyl- is 225.9975 g/mol.
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