2-((3-(Dimethylamino)propyl)methylamino)ethanol
TL;DR: 2-((3-(Dimethylamino)propyl)methylamino)ethanol (CAS 82131-93-9) is a chemical compound with molecular formula C16H14F3NO4 and molecular weight 341.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyethyl 5-hydroxy-2-[3-(trifluoromethyl)anilino]benzoate
Also Known As: 2-((3-(Dimethylamino)propyl)methylamino)ethanol, Benzoic acid, 5-hydroxy-2-((3-(trifluoromethyl)phenyl)amino)-,2-hydroxyethyl ester, 2-hydroxyethyl 5-hydroxy-2-[3-(trifluoromethyl)anilino]benzoate
| Molecular Formula | C16H14F3NO4 |
|---|---|
| Molecular Weight | 341.09 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 78.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 341.0875 |
| Heavy Atoms | 24 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 82131-93-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC2=C(C=C(C=C2)O)C(=O)OCCO)C(F)(F)F |
| InChIKey | DVOOQWRUTZUUNT-UHFFFAOYSA-N |
Product Overview
2-((3-(Dimethylamino)propyl)methylamino)ethanol (CAS 82131-93-9), with molecular formula C16H14F3NO4 and molecular weight 341.09 g/mol. IUPAC: 2-hydroxyethyl 5-hydroxy-2-[3-(trifluoromethyl)anilino]benzoate.
Chemical Property Profile of 2-((3-(Dimethylamino)propyl)methylamino)ethanol
Property Insights of 2-((3-(Dimethylamino)propyl)methylamino)ethanol
The XLogP value of 4.5 indicates that 2-((3-(Dimethylamino)propyl)methylamino)ethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((3-(Dimethylamino)propyl)methylamino)ethanol. Following Lipinski's Rule of Five, 2-((3-(Dimethylamino)propyl)methylamino)ethanol has 3 hydrogen bond donor(s) and 8 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-((3-(Dimethylamino)propyl)methylamino)ethanol?
The CAS number of 2-((3-(Dimethylamino)propyl)methylamino)ethanol is 82131-93-9.
What is the molecular formula of 2-((3-(Dimethylamino)propyl)methylamino)ethanol?
The molecular formula of 2-((3-(Dimethylamino)propyl)methylamino)ethanol is C16H14F3NO4.
What is the molecular weight of 2-((3-(Dimethylamino)propyl)methylamino)ethanol?
The molecular weight of 2-((3-(Dimethylamino)propyl)methylamino)ethanol is 341.09 g/mol.
Where can I buy 2-((3-(Dimethylamino)propyl)methylamino)ethanol?
You can request a quote for 2-((3-(Dimethylamino)propyl)methylamino)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((3-(Dimethylamino)propyl)methylamino)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-((3-(Dimethylamino)propyl)methylamino)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.