TL;DR: Acetic acid, trichloro-, 2,2-bis(2-chloroethyl)hydrazide (CAS 99420-58-3) is a chemical compound with molecular formula C6H9Cl5N2O and molecular weight 299.91574 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,2-trichloro-N',N'-bis(2-chloroethyl)acetohydrazide
Also Known As: 1-Trichloroacetyl-2,2-bis(2-chloroethyl)hydrazine, ACETIC ACID, TRICHLORO-, 2,2-BIS(2-CHLOROETHYL)HYDRAZIDE, Trichloroacetic acid, 2,2-bis(2-chloroethyl)hydrazide, 2,2,2-trichloro-N',N'-bis(2-chloroethyl)acetohydrazide, 2,2,2-Trichloro-N ,N -bis(2-chloroethyl)acetohydrazide
| Molecular Formula | C6H9Cl5N2O |
| Molecular Weight | 299.91574 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.9128 Da |
| Heavy Atoms | 14 |
| Complexity | 178.0 |
| SMILES | C(CCl)N(CCCl)NC(=O)C(Cl)(Cl)Cl |
| InChIKey | LNPDHFLPDRDAOH-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, trichloro-, 2,2-bis(2-chloroethyl)hydrazide. With a topological polar surface area (TPSA) of 32.3 Ų, Acetic acid, trichloro-, 2,2-bis(2-chloroethyl)hydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, trichloro-, 2,2-bis(2-chloroethyl)hydrazide 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 Acetic acid, trichloro-, 2,2-bis(2-chloroethyl)hydrazide is 99420-58-3.
The molecular formula of Acetic acid, trichloro-, 2,2-bis(2-chloroethyl)hydrazide is C6H9Cl5N2O.
The molecular weight of Acetic acid, trichloro-, 2,2-bis(2-chloroethyl)hydrazide is 299.91574 g/mol.
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