2-(Diallylamino)ethanol
TL;DR: 2-(Diallylamino)ethanol (CAS 17801-44-4) is a chemical compound with molecular formula C8H15NO and molecular weight 141.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(prop-2-enyl)amino]ethanol
Also Known As: Diallylethanolamine, 2-(Diallylamino)ethanol, Ethanol, 2-(diallylamino)-, N,N-Diallylethanolamine, N,N-Diallylaminoethanol
| Molecular Formula | C8H15NO |
|---|---|
| Molecular Weight | 141.12 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 141.11537 |
| Heavy Atoms | 10 |
| Complexity | 91.0 |
Chemical Identifiers
| CAS Number | 17801-44-4 |
|---|---|
| SMILES | C=CCN(CCO)CC=C |
| InChIKey | NSXPSOZPCYEURW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Diallylamino)ethanol (CAS 17801-44-4), with molecular formula C8H15NO and molecular weight 141.12 g/mol. IUPAC: 2-[bis(prop-2-enyl)amino]ethanol.
Chemical Property Profile of 2-(Diallylamino)ethanol
Property Insights of 2-(Diallylamino)ethanol
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Diallylamino)ethanol. With a topological polar surface area (TPSA) of 23.5 Ų, 2-(Diallylamino)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Diallylamino)ethanol has 1 hydrogen bond donor(s) and 2 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-(Diallylamino)ethanol?
The CAS number of 2-(Diallylamino)ethanol is 17801-44-4.
What is the molecular formula of 2-(Diallylamino)ethanol?
The molecular formula of 2-(Diallylamino)ethanol is C8H15NO.
What is the molecular weight of 2-(Diallylamino)ethanol?
The molecular weight of 2-(Diallylamino)ethanol is 141.12 g/mol.
Where can I buy 2-(Diallylamino)ethanol?
You can request a quote for 2-(Diallylamino)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Diallylamino)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(Diallylamino)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.