![2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid structure](/static/products/8520/85204-21-3.webp)
2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid
TL;DR: 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid (CAS 85204-21-3) is a chemical compound with molecular formula C18H36N2O6 and molecular weight 376.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid
Also Known As: (2Z)-3-[(2-ETHYLHEXYL)CARBAMOYL]PROP-2-ENOIC ACID; TRIETHANOLAMINE
| Molecular Formula | C18H36N2O6 |
|---|---|
| Molecular Weight | 376.26 g/mol |
| LogP | 0.2251 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 376.25732 |
| Heavy Atoms | 26 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 85204-21-3 |
|---|---|
| SMILES | CCCCC(CC)CNC(=O)C=CC(=O)O.C(CO)N(CCO)CCO |
| InChIKey | PODFZGCPYCFIIE-UHFFFAOYSA-N |
Product Overview
2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid (CAS 85204-21-3), with molecular formula C18H36N2O6 and molecular weight 376.26 g/mol. IUPAC: 2-[bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid.
Chemical Property Profile of 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid
Property Insights of 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid
The XLogP value of 0.2251 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid. Following Lipinski's Rule of Five, 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid 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 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid?
The CAS number of 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid is 85204-21-3.
What is the molecular formula of 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid?
The molecular formula of 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid is C18H36N2O6.
What is the molecular weight of 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid?
The molecular weight of 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid is 376.26 g/mol.
Where can I buy 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid?
You can request a quote for 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[Bis(2-hydroxyethyl)amino]ethanol;4-(2-ethylhexylamino)-4-oxobut-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.