Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer
TL;DR: Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer (CAS 34547-20-1) is a chemical compound with molecular formula C24H39N3O5 and molecular weight 449.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine;azepan-2-one;benzene-1,3-dicarboxylic acid
Also Known As: Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer, (C10-H22-N2.C8-H6-O4.C6-H11-N-O)x-, 3-(aminomethyl)-3,5,5-trimethyl-cyclohexan-1-amine; azepan-2-one; isophthalic acid, Copolymer of caprolactam, isophthalic acid, and isophoronediamine, 1,3-Benzenedicarboxylic acid, polymer with 5-amino-1,3,3-trimethylcyclohexanemethanamine and hexahydro-2H-azepin-2-one
| Molecular Formula | C24H39N3O5 |
|---|---|
| Molecular Weight | 449.29 g/mol |
| LogP | 3.2484 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 449.28897 |
| Heavy Atoms | 32 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 34547-20-1 |
|---|---|
| SMILES | CC1(CC(CC(C1)(C)CN)N)C.C1CCC(=O)NCC1.C1=CC(=CC(=C1)C(=O)O)C(=O)O |
| InChIKey | IVSDNHIIFXZOSJ-UHFFFAOYSA-N |
Product Overview
Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer (CAS 34547-20-1), with molecular formula C24H39N3O5 and molecular weight 449.29 g/mol. IUPAC: 3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine;azepan-2-one;benzene-1,3-dicarboxylic acid.
Chemical Property Profile of Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer
Property Insights of Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer
The XLogP value of 3.2484 indicates that Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 156.0 Ų indicates high polarity, suggesting Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer has 5 hydrogen bond donor(s) and 7 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 Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer?
The CAS number of Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer is 34547-20-1.
What is the molecular formula of Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer?
The molecular formula of Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer is C24H39N3O5.
What is the molecular weight of Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer?
The molecular weight of Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer is 449.29 g/mol.
Where can I buy Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer?
You can request a quote for Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer?
Yes, KEHONG BIO provides custom synthesis services for Isophthalic acid, epsilon-caprolactam, isophorone diamine polymer and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.