Choline, iodide, m-aminobenzoate
TL;DR: Choline, iodide, m-aminobenzoate (CAS 2393-39-7) is a chemical compound with molecular formula C12H19IN2O2 and molecular weight 350.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-aminobenzoyl)oxyethyl-trimethylazanium iodide
Also Known As: m-Aminobenzoylcholine iodide, Choline, iodide, m-aminobenzoate, CHOLINE IODIDE M-AMINOBENZOATE, Benzoic acid, m-amino ester with choline iodide, 2-(3-aminobenzoyl)oxyethyl-trimethylazanium iodide
| Molecular Formula | C12H19IN2O2 |
|---|---|
| Molecular Weight | 350.05 g/mol |
| LogP | -1.8642 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.04913 |
| Heavy Atoms | 17 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 2393-39-7 |
|---|---|
| SMILES | C[N+](C)(C)CCOC(=O)C1=CC(=CC=C1)N.[I-] |
| InChIKey | FNFFUKIYQYJZDT-UHFFFAOYSA-M |
Product Overview
Choline, iodide, m-aminobenzoate (CAS 2393-39-7), with molecular formula C12H19IN2O2 and molecular weight 350.05 g/mol. IUPAC: 2-(3-aminobenzoyl)oxyethyl-trimethylazanium iodide.
Chemical Property Profile of Choline, iodide, m-aminobenzoate
Property Insights of Choline, iodide, m-aminobenzoate
The XLogP value of -1.8642 indicates that Choline, iodide, m-aminobenzoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.3 Ų, Choline, iodide, m-aminobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Choline, iodide, m-aminobenzoate has 1 hydrogen bond donor(s) and 4 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 Choline, iodide, m-aminobenzoate?
The CAS number of Choline, iodide, m-aminobenzoate is 2393-39-7.
What is the molecular formula of Choline, iodide, m-aminobenzoate?
The molecular formula of Choline, iodide, m-aminobenzoate is C12H19IN2O2.
What is the molecular weight of Choline, iodide, m-aminobenzoate?
The molecular weight of Choline, iodide, m-aminobenzoate is 350.05 g/mol.
Where can I buy Choline, iodide, m-aminobenzoate?
You can request a quote for Choline, iodide, m-aminobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Choline, iodide, m-aminobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Choline, iodide, m-aminobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.