Tris(p-isocyanatophenyl)amine
TL;DR: Tris(p-isocyanatophenyl)amine (CAS 19759-70-7) is a chemical compound with molecular formula C21H12N4O3 and molecular weight 368.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-isocyanato-N,N-bis(4-isocyanatophenyl)aniline
Also Known As: Tris(p-isocyanatophenyl)amine, TIPA, 4-isocyanato-N,N-bis(4-isocyanatophenyl)aniline, 4,4',4''-Triisocyanatotriphenylamine, Isocyanic Acid Nitrilotri-p-phenylene Ester
| Molecular Formula | C21H12N4O3 |
|---|---|
| Molecular Weight | 368.09 g/mol |
| LogP | 5.0583 |
| Topological Polar Surface Area | 91.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 368.09094 |
| Heavy Atoms | 28 |
| Complexity | 957.6093 |
Chemical Identifiers
| CAS Number | 19759-70-7 |
|---|---|
| SMILES | C1=CC(=CC=C1N=C=O)N(C2=CC=C(C=C2)N=C=O)C3=CC=C(C=C3)N=C=O |
Product Overview
Tris(p-isocyanatophenyl)amine (CAS 19759-70-7), with molecular formula C21H12N4O3 and molecular weight 368.09 g/mol. IUPAC: 4-isocyanato-N,N-bis(4-isocyanatophenyl)aniline.
Chemical Property Profile of Tris(p-isocyanatophenyl)amine
Property Insights of Tris(p-isocyanatophenyl)amine
The XLogP value of 5.0583 indicates that Tris(p-isocyanatophenyl)amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.53 Ų falls within the moderate polarity range, balancing permeability and solubility for Tris(p-isocyanatophenyl)amine. Following Lipinski's Rule of Five, Tris(p-isocyanatophenyl)amine has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tris(p-isocyanatophenyl)amine?
The CAS number of Tris(p-isocyanatophenyl)amine is 19759-70-7.
What is the molecular formula of Tris(p-isocyanatophenyl)amine?
The molecular formula of Tris(p-isocyanatophenyl)amine is C21H12N4O3.
What is the molecular weight of Tris(p-isocyanatophenyl)amine?
The molecular weight of Tris(p-isocyanatophenyl)amine is 368.09 g/mol.
Where can I buy Tris(p-isocyanatophenyl)amine?
You can request a quote for Tris(p-isocyanatophenyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tris(p-isocyanatophenyl)amine?
Yes, KEHONG BIO provides custom synthesis services for Tris(p-isocyanatophenyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.