TL;DR: Xylene formaldehyde (CAS 126341-24-0) is a chemical compound with molecular formula C9H12O and molecular weight 136.08882 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
formaldehyde;1,2-xylene
Also Known As: xylene formaldehyde, formaldehyde; 1,2-xylene, POLY(FORMALDEHYDE-CO-XYLENE), Formaldehyde, polymer with dimethylbenzene, Formaldehyde--1,2-xylene (1/1)
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H12O |
| Molecular Weight | 136.08882 g/mol |
| XLogP | 2.11854 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 136.08882 Da |
| Heavy Atoms | 10 |
| Complexity | 58.0 |
| SMILES | CC1=CC=CC=C1C.C=O |
| InChIKey | ZCJGPLOQDMFGAR-UHFFFAOYSA-N |
The XLogP value of 2.11854 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Xylene formaldehyde. With a topological polar surface area (TPSA) of 17.1 Ų, Xylene formaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Xylene formaldehyde has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Xylene formaldehyde is 126341-24-0.
The molecular formula of Xylene formaldehyde is C9H12O.
The molecular weight of Xylene formaldehyde is 136.08882 g/mol.
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