![1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1) structure](/static/products/5175/51755-37-4.webp)
1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1)
TL;DR: 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1) (CAS 51755-37-4) is a chemical compound with molecular formula C13H29NO3 and molecular weight 247.21474 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
acetic acid;3-(2-ethylhexoxy)propan-1-amine
Also Known As: 3-[oxy]propylammoniumacetate, 3-(2-Ethylhexyloxy)propylamine acetate, 1-Propanamine, 3-((2-ethylhexyl)oxy)-, acetate, 3-[(2-ethylhexyl)oxy]propan-1-aminium acetate, 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate
Technical Specifications
| Molecular Formula | C13H29NO3 |
| Molecular Weight | 247.21474 g/mol |
| XLogP | 2.66 |
| Topological Polar Surface Area (TPSA) | 72.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 247.21474 Da |
| Heavy Atoms | 17 |
| Complexity | 127.0 |
| SMILES | CCCCC(CC)COCCCN.CC(=O)O |
| InChIKey | JLCVIBWCTKPHCN-UHFFFAOYSA-N |
Chemical Property Profile of 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1)
Property Insights of 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1)
The XLogP value of 2.66 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1). The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1). Following Lipinski's Rule of Five, 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1) has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1)?
The CAS number of 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1) is 51755-37-4.
What is the molecular formula of 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1)?
The molecular formula of 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1) is C13H29NO3.
What is the molecular weight of 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1)?
The molecular weight of 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1) is 247.21474 g/mol.
Where can I buy 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1)?
You can request a quote for 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1)?
Yes, CoreyChem provides custom synthesis services for 1-Propanamine, 3-[(2-ethylhexyl)oxy]-, acetate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.