Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate
TL;DR: Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate (CAS 47309-20-6) is a chemical compound with molecular formula C18H19NO4 and molecular weight 313.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-benzoyloxyethylamino)ethyl benzoate
Also Known As: 2- ethylbenzoate, Ethanol, 2,2'-iminobis-, dibenzoate (ester), 2-(2-benzoyloxyethylamino)ethyl benzoate, Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate, 2,2 -Iminobisethanol dibenzoate
| Molecular Formula | C18H19NO4 |
|---|---|
| Molecular Weight | 313.13 g/mol |
| LogP | 2.29 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 313.1314 |
| Heavy Atoms | 23 |
| Complexity | 557.9334 |
Chemical Identifiers
| CAS Number | 47309-20-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OCCNCCOC(=O)C2=CC=CC=C2 |
Product Overview
Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate (CAS 47309-20-6), with molecular formula C18H19NO4 and molecular weight 313.13 g/mol. IUPAC: 2-(2-benzoyloxyethylamino)ethyl benzoate.
Chemical Property Profile of Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate
Property Insights of Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate
The XLogP value of 2.29 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate. Following Lipinski's Rule of Five, Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate has 1 hydrogen bond donor(s) and 5 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 Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate?
The CAS number of Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate is 47309-20-6.
What is the molecular formula of Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate?
The molecular formula of Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate is C18H19NO4.
What is the molecular weight of Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate?
The molecular weight of Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate is 313.13 g/mol.
Where can I buy Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate?
You can request a quote for Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethanol, 2,2'-iminobis-, 1,1'-dibenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.