TL;DR: Crotonanilide, 3-chloro-4'-hydroxy- (CAS 101030-71-1) is a chemical compound with molecular formula C10H10ClNO2 and molecular weight 211.04001 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-3-chloro-N-(4-hydroxyphenyl)but-2-enamide
Also Known As: 3-Chloro-4'-hydroxycrotonanilide, CROTONANILIDE, 3-CHLORO-4'-HYDROXY-, CROTONANILIDE,3-CHLORO-4'-HYDROXY, 3-chloro-N-(4-hydroxyphenyl)but-2-enamide, N-(4-Hydroxyphenyl)-3-chloro-2-butenamide
| Molecular Formula | C10H10ClNO2 |
| Molecular Weight | 211.04001 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.04001 Da |
| Heavy Atoms | 14 |
| Complexity | 232.0 |
| SMILES | C/C(=C/C(=O)NC1=CC=C(C=C1)O)/Cl |
| InChIKey | WZFJKTHDWJDCPG-SREVYHEPSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Crotonanilide, 3-chloro-4'-hydroxy-. With a topological polar surface area (TPSA) of 49.3 Ų, Crotonanilide, 3-chloro-4'-hydroxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Crotonanilide, 3-chloro-4'-hydroxy- has 2 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 Crotonanilide, 3-chloro-4'-hydroxy- is 101030-71-1.
The molecular formula of Crotonanilide, 3-chloro-4'-hydroxy- is C10H10ClNO2.
The molecular weight of Crotonanilide, 3-chloro-4'-hydroxy- is 211.04001 g/mol.
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