TL;DR: Daminozide (CAS 1596-84-5) is a chemical compound with molecular formula C6H12N2O3 and molecular weight 160.0848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2,2-dimethylhydrazinyl)-4-oxobutanoic acid
Also Known As: Daminozide, Aminozide, Kylar, Dimas, ALAR
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6H12N2O3 |
| Molecular Weight | 160.0848 g/mol |
| XLogP | -3.1 |
| Topological Polar Surface Area (TPSA) | 69.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 160.0848 Da |
| Heavy Atoms | 11 |
| Complexity | 156.0 |
| Melting Point | 309 to 311 °F (NTP, 1992) |
| Vapor Pressure | less than 0.0000750 mmHg at 68 °F (NTP, 1992) |
| Solubility | 1 to 10 mg/mL at 75 °F (NTP, 1992) |
| SMILES | CN(C)NC(=O)CCC(=O)O |
| InChIKey | NOQGZXFMHARMLW-UHFFFAOYSA-N |
The XLogP value of -3.1 indicates that Daminozide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Daminozide. Following Lipinski's Rule of Five, Daminozide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Daminozide is 1596-84-5.
The molecular formula of Daminozide is C6H12N2O3.
The molecular weight of Daminozide is 160.0848 g/mol.
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