Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer
TL;DR: Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer (CAS 51293-82-4) is a chemical compound with molecular formula C32H60N4O8 and molecular weight 628.44 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;butane-1,4-diol;hexanedioic acid;5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane
Also Known As: Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer, (C12-H18-N2-O2.C10-H22-N2.C6-H10-O4.C4-H10-O2)x-, Hexanedioic acid, polymer with 5-amino-1,3,3-trimethylcyclohexanemethanamine, 1,4-butanediol and 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane, 1,4-Butanediol, isophorone diisocyanate, adipic acid, isophoronediamine polymer, 3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine; butane-1,4-diol; hexanedioic acid; 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane
| Molecular Formula | C32H60N4O8 |
|---|---|
| Molecular Weight | 628.44 g/mol |
| LogP | 4.199 |
| Topological Polar Surface Area | 226.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 12 |
| Exact Mass | 628.4411 |
| Heavy Atoms | 44 |
| Complexity | 648.0 |
Chemical Identifiers
| CAS Number | 51293-82-4 |
|---|---|
| SMILES | CC1(CC(CC(C1)(C)CN)N)C.CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C.C(CCC(=O)O)CC(=O)O.C(CCO)CO |
| InChIKey | GTFWGJCLVCYKJV-UHFFFAOYSA-N |
Product Overview
Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer (CAS 51293-82-4), with molecular formula C32H60N4O8 and molecular weight 628.44 g/mol. IUPAC: 3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine;butane-1,4-diol;hexanedioic acid;5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane.
Chemical Property Profile of Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer
Property Insights of Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer
The XLogP value of 4.199 indicates that Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 226.0 Ų indicates high polarity, suggesting Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer?
The CAS number of Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer is 51293-82-4.
What is the molecular formula of Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer?
The molecular formula of Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer is C32H60N4O8.
What is the molecular weight of Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer?
The molecular weight of Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer is 628.44 g/mol.
Where can I buy Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer?
You can request a quote for Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer?
Yes, KEHONG BIO provides custom synthesis services for Adipic acid, 1,4-butanediol, isophorone diisocyanate, isophorone diamine copolymer and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.