2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1)
TL;DR: 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1) (CAS 100482-40-4) is a chemical compound with molecular formula C16H27ClN2O3 and molecular weight 330.17102 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-hydroxy-3-[4-(propylamino)benzoyl]oxypropyl]-propylazanium chloride
Also Known As: 4-Biphenylglyoxal,monosodium bisulphite, Benzoic acid, p-(propylamino)-, 2-hydroxy-3-(propylamino)propyl ester, hydrochloride, 2-Hydroxy-3-(propylamino)propyl p-(propylamino)benzoate hydrochloride, [2-hydroxy-3-[4-(propylamino)benzoyl]oxypropyl]-propylazanium;chloride, [2-hydroxy-3-[4-(propylamino)benzoyl]oxypropyl]-propylazanium chloride
Technical Specifications
| Molecular Formula | C16H27ClN2O3 |
| Molecular Weight | 330.17102 g/mol |
| XLogP | -2.0 |
| Topological Polar Surface Area (TPSA) | 75.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 330.17102 Da |
| Heavy Atoms | 22 |
| Complexity | 279.0 |
| SMILES | CCC[NH2+]CC(COC(=O)C1=CC=C(C=C1)NCCC)O.[Cl-] |
| InChIKey | UCDTWBJKPRGBCE-UHFFFAOYSA-N |
Chemical Property Profile of 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1)
Property Insights of 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1)
The XLogP value of -2.0 indicates that 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1). Following Lipinski's Rule of Five, 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1) has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1)?
The CAS number of 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1) is 100482-40-4.
What is the molecular formula of 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1)?
The molecular formula of 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1) is C16H27ClN2O3.
What is the molecular weight of 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1)?
The molecular weight of 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1) is 330.17102 g/mol.
Where can I buy 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1)?
You can request a quote for 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1)?
Yes, CoreyChem provides custom synthesis services for 2-Hydroxy-3-(propylamino)propyl 4-(propylamino)benzoate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.