TL;DR: (1Z)-3-Chloro-N-hydroxy-2-oxopropanimidoyl chloride (CAS 1381841-81-1) is a chemical compound with molecular formula C3H3Cl2NO2 and molecular weight 154.95409 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1Z)-3-chloro-N-hydroxy-2-oxopropanimidoyl chloride
Also Known As: 1,3-dichloro-1-oximino-2-propanone, (1Z)-3-Chloro-N-hydroxy-2-oxopropanimidoyl chloride, 3-chloro-N-hydroxy-2-oxopropanimidoyl chloride, Propanimidoylchloride,3-chloro-N-hydroxy-2-oxo-
| Molecular Formula | C3H3Cl2NO2 |
| Molecular Weight | 154.95409 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 49.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 154.95409 Da |
| Heavy Atoms | 8 |
| Complexity | 122.0 |
| SMILES | C(C(=O)/C(=N/O)/Cl)Cl |
| InChIKey | IAPUXXZOKAZTNA-UTCJRWHESA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1Z)-3-Chloro-N-hydroxy-2-oxopropanimidoyl chloride. With a topological polar surface area (TPSA) of 49.7 Ų, (1Z)-3-Chloro-N-hydroxy-2-oxopropanimidoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1Z)-3-Chloro-N-hydroxy-2-oxopropanimidoyl chloride has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (1Z)-3-Chloro-N-hydroxy-2-oxopropanimidoyl chloride is 1381841-81-1.
The molecular formula of (1Z)-3-Chloro-N-hydroxy-2-oxopropanimidoyl chloride is C3H3Cl2NO2.
The molecular weight of (1Z)-3-Chloro-N-hydroxy-2-oxopropanimidoyl chloride is 154.95409 g/mol.
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