Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester
TL;DR: Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester (CAS 60075-92-5) is a chemical compound with molecular formula C14H18I3NO3 and molecular weight 628.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-amino-2,4,6-triiodophenyl)methyl hexyl carbonate
Also Known As: (3-Amino-2,4,6-triiodophenyl)methyl hexyl carbonate, Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester, BRN 2950159, RefChem:333322
| Molecular Formula | C14H18I3NO3 |
|---|---|
| Molecular Weight | 628.84 g/mol |
| LogP | 5.3161 |
| Topological Polar Surface Area | 61.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 628.8421 |
| Heavy Atoms | 21 |
| Complexity | 494.84283 |
Chemical Identifiers
| CAS Number | 60075-92-5 |
|---|---|
| SMILES | CCCCCCOC(=O)OCC1=C(C(=C(C=C1I)I)N)I |
Product Overview
Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester (CAS 60075-92-5), with molecular formula C14H18I3NO3 and molecular weight 628.84 g/mol. IUPAC: (3-amino-2,4,6-triiodophenyl)methyl hexyl carbonate.
Chemical Property Profile of Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester
Property Insights of Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester
The XLogP value of 5.3161 indicates that Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.55 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester. Following Lipinski's Rule of Five, Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester?
The CAS number of Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester is 60075-92-5.
What is the molecular formula of Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester?
The molecular formula of Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester is C14H18I3NO3.
What is the molecular weight of Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester?
The molecular weight of Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester is 628.84 g/mol.
Where can I buy Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester?
You can request a quote for Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbonic acid, (3-amino-2,4,6-triiodophenyl)methyl hexyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.