(1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid
TL;DR: (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid (CAS 113592-29-3) is a chemical compound with molecular formula C12H26NO4P and molecular weight 279.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[1-aminoethyl(hydroxy)phosphoryl]methyl]nonanoic acid
Also Known As: Heptyl phosphinate, (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid, 1-Aminoethyl-[2-carboxy-1-nonyl]phosphinic acid, 2-(((1-Aminoethyl)hydroxyphosphinyl)methyl)nonanoic acid, 2-[[1-aminoethyl(hydroxy)phosphoryl]methyl]nonanoic acid
| Molecular Formula | C12H26NO4P |
|---|---|
| Molecular Weight | 279.16 g/mol |
| LogP | 2.6228 |
| Topological Polar Surface Area | 100.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 279.15994 |
| Heavy Atoms | 18 |
| Complexity | 293.802 |
Chemical Identifiers
| CAS Number | 113592-29-3 |
|---|---|
| SMILES | CCCCCCCC(CP(=O)(C(C)N)O)C(=O)O |
Product Overview
(1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid (CAS 113592-29-3), with molecular formula C12H26NO4P and molecular weight 279.16 g/mol. IUPAC: 2-[[1-aminoethyl(hydroxy)phosphoryl]methyl]nonanoic acid.
Chemical Property Profile of (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid
Property Insights of (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid
The XLogP value of 2.6228 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid. The TPSA of 100.62 Ų falls within the moderate polarity range, balancing permeability and solubility for (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid. Following Lipinski's Rule of Five, (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid?
The CAS number of (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid is 113592-29-3.
What is the molecular formula of (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid?
The molecular formula of (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid is C12H26NO4P.
What is the molecular weight of (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid?
The molecular weight of (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid is 279.16 g/mol.
Where can I buy (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid?
You can request a quote for (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid?
Yes, KEHONG BIO provides custom synthesis services for (1-Aminoethyl)(2-carboxy-1-octyl)phosphinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.