TL;DR: 2-Phenylvinyl acetate (CAS 10521-96-7) is a chemical compound with molecular formula C10H10O2 and molecular weight 162.06808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-phenylethenyl acetate
Also Known As: Styryl acetate, acetoxystyrene, 2-Phenylvinyl acetate, 2-phenylethenyl acetate, Ethenol, 2-phenyl-, acetate
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H10O2 |
| Molecular Weight | 162.06808 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 162.06808 Da |
| Heavy Atoms | 12 |
| Complexity | 167.0 |
| SMILES | CC(=O)OC=CC1=CC=CC=C1 |
| InChIKey | FMFHUEMLVAIBFI-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phenylvinyl acetate. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Phenylvinyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenylvinyl acetate 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 2-Phenylvinyl acetate is 10521-96-7.
The molecular formula of 2-Phenylvinyl acetate is C10H10O2.
The molecular weight of 2-Phenylvinyl acetate is 162.06808 g/mol.
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