Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo-
TL;DR: Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo- (CAS 51374-99-3) is a chemical compound with molecular formula C13H14I3NO3 and molecular weight 612.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-acetamido-2,4,6-triiodophenyl)methyl]butanoic acid
Also Known As: N-Acetyliopanoic acid, 3-Acetamido-alpha-ethyl-2,4,6-triiodohydrocinnamic acid, 4-14-00-01741 (Beilstein Handbook Reference), 2-[(3-acetamido-2,4,6-triiodophenyl)methyl]butanoic acid, HYDROCINNAMIC ACID, 3-ACETAMIDO-alpha-ETHYL-2,4,6-TRIIODO-
| Molecular Formula | C13H14I3NO3 |
|---|---|
| Molecular Weight | 612.81 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 612.8108 |
| Heavy Atoms | 20 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 51374-99-3 |
|---|---|
| SMILES | CCC(CC1=C(C(=C(C=C1I)I)NC(=O)C)I)C(=O)O |
| InChIKey | VIWQRTRTPHAESA-UHFFFAOYSA-N |
Product Overview
Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo- (CAS 51374-99-3), with molecular formula C13H14I3NO3 and molecular weight 612.81 g/mol. IUPAC: 2-[(3-acetamido-2,4,6-triiodophenyl)methyl]butanoic acid.
Chemical Property Profile of Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo-
Property Insights of Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo-
The XLogP value of 3.7 indicates that Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo-. Following Lipinski's Rule of Five, Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo-?
The CAS number of Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo- is 51374-99-3.
What is the molecular formula of Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo-?
The molecular formula of Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo- is C13H14I3NO3.
What is the molecular weight of Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo-?
The molecular weight of Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo- is 612.81 g/mol.
Where can I buy Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo-?
You can request a quote for Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo-?
Yes, KEHONG BIO provides custom synthesis services for Hydrocinnamic acid, 3-acetamido-alpha-ethyl-2,4,6-triiodo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.