TL;DR: Di(2-acetoxy-n-propyl)amine (CAS 100700-31-0) is a chemical compound with molecular formula C10H19NO4 and molecular weight 217.13141 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(3-carboxy-2-methylpropyl)amino]-3-methylbutanoic acid
Also Known As: Di(2-acetoxy-n-propyl)amine, 4,4'-Iminobis(3-methylbutyric acid), 4,4'-iminobis(3-methylbutanoic acid), 4,4 -Iminobis(3-methylbutyric acid), BUTYRIC ACID, 4,4'-IMINOBIS(3-METHYL-
| Molecular Formula | C10H19NO4 |
| Molecular Weight | 217.13141 g/mol |
| XLogP | -1.9 |
| Topological Polar Surface Area (TPSA) | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 217.13141 Da |
| Heavy Atoms | 15 |
| Complexity | 195.0 |
| SMILES | CC(CC(=O)O)CNCC(C)CC(=O)O |
| InChIKey | PHCVDJRANJTXAC-UHFFFAOYSA-N |
The XLogP value of -1.9 indicates that Di(2-acetoxy-n-propyl)amine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Di(2-acetoxy-n-propyl)amine. Following Lipinski's Rule of Five, Di(2-acetoxy-n-propyl)amine has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Di(2-acetoxy-n-propyl)amine is 100700-31-0.
The molecular formula of Di(2-acetoxy-n-propyl)amine is C10H19NO4.
The molecular weight of Di(2-acetoxy-n-propyl)amine is 217.13141 g/mol.
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