TL;DR: 2H-1-Benzopyran-2-ol, 4-chloro- (CAS 145982-62-3) is a chemical compound with molecular formula C9H7ClO2 and molecular weight 182.01346 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-2H-chromen-2-ol
Also Known As: 4-chloro-2H-chromen-2-ol, 2H-1-Benzopyran-2-ol, 4-chloro-, 4-chloro-2H-1-benzopyran-2-ol
| Molecular Formula | C9H7ClO2 |
| Molecular Weight | 182.01346 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 182.01346 Da |
| Heavy Atoms | 12 |
| Complexity | 203.0 |
| SMILES | C1=CC=C2C(=C1)C(=CC(O2)O)Cl |
| InChIKey | RHDSFFCRQBEKRV-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1-Benzopyran-2-ol, 4-chloro-. With a topological polar surface area (TPSA) of 29.5 Ų, 2H-1-Benzopyran-2-ol, 4-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1-Benzopyran-2-ol, 4-chloro- 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 2H-1-Benzopyran-2-ol, 4-chloro- is 145982-62-3.
The molecular formula of 2H-1-Benzopyran-2-ol, 4-chloro- is C9H7ClO2.
The molecular weight of 2H-1-Benzopyran-2-ol, 4-chloro- is 182.01346 g/mol.
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