acetic acid-(2,4-di-tert-butyl-anilide)
TL;DR: acetic acid-(2,4-di-tert-butyl-anilide) (CAS 38896-90-1) is a chemical compound with molecular formula C16H13I4NO3 and molecular weight 774.71 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-3-[4-[(4-hydroxy-3,5-diiodophenyl)methyl]-3,5-diiodophenyl]propanoic acid
Also Known As: acetic acid-(2,4-di-tert-butyl-anilide), (2S)-2-amino-3-[4-[(4-hydroxy-3,5-diiodophenyl)methyl]-3,5-diiodophenyl]propanoic acid, 4-[(4-Hydroxy-3,5-diiodophenyl)methyl]-3,5-diiodo-L-phenylalanine, Phenylalanine, 4-[(4-hydroxy-3,5-diiodophenyl)methyl]-3,5-diiodo-, (2S)-2-amino-3-[4-[(4-hydroxy-3,5-diiodo-phenyl)methyl]-3,5-diiodo-phenyl]propanoic Acid
| Molecular Formula | C16H13I4NO3 |
|---|---|
| Molecular Weight | 774.71 g/mol |
| LogP | 4.3558 |
| Topological Polar Surface Area | 83.55 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 774.7074 |
| Heavy Atoms | 24 |
| Complexity | 748.8774 |
Chemical Identifiers
| CAS Number | 38896-90-1 |
|---|---|
| SMILES | C1=C(C=C(C(=C1I)O)I)CC2=C(C=C(C=C2I)C[C@@H](C(=O)O)N)I |
Product Overview
acetic acid-(2,4-di-tert-butyl-anilide) (CAS 38896-90-1), with molecular formula C16H13I4NO3 and molecular weight 774.71 g/mol. IUPAC: (2S)-2-amino-3-[4-[(4-hydroxy-3,5-diiodophenyl)methyl]-3,5-diiodophenyl]propanoic acid.
Chemical Property Profile of acetic acid-(2,4-di-tert-butyl-anilide)
Property Insights of acetic acid-(2,4-di-tert-butyl-anilide)
The XLogP value of 4.3558 indicates that acetic acid-(2,4-di-tert-butyl-anilide) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.55 Ų falls within the moderate polarity range, balancing permeability and solubility for acetic acid-(2,4-di-tert-butyl-anilide). Following Lipinski's Rule of Five, acetic acid-(2,4-di-tert-butyl-anilide) has 3 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 acetic acid-(2,4-di-tert-butyl-anilide)?
The CAS number of acetic acid-(2,4-di-tert-butyl-anilide) is 38896-90-1.
What is the molecular formula of acetic acid-(2,4-di-tert-butyl-anilide)?
The molecular formula of acetic acid-(2,4-di-tert-butyl-anilide) is C16H13I4NO3.
What is the molecular weight of acetic acid-(2,4-di-tert-butyl-anilide)?
The molecular weight of acetic acid-(2,4-di-tert-butyl-anilide) is 774.71 g/mol.
Where can I buy acetic acid-(2,4-di-tert-butyl-anilide)?
You can request a quote for acetic acid-(2,4-di-tert-butyl-anilide) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for acetic acid-(2,4-di-tert-butyl-anilide)?
Yes, KEHONG BIO provides custom synthesis services for acetic acid-(2,4-di-tert-butyl-anilide) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.