5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol
TL;DR: 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol (CAS 64632-44-6) is a chemical compound with molecular formula C10H15NO3 and molecular weight 197.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-aminoethyl)-3,6-dimethylbenzene-1,2,4-triol
Also Known As: 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol, C(CN)c1c(C)c(O)c(O)c(C)c1O, 5-(2-aminoethyl)-3,6-dimethylbenzene-1,2,4-triol, 5-(2-aminoethyl)-3,6-dimethyl-benzene-1,2,4-triol, 1,2,4-Benzenetriol, 5-(2-aminoethyl)-3,6-dimethyl-
| Molecular Formula | C10H15NO3 |
|---|---|
| Molecular Weight | 197.11 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 197.1052 |
| Heavy Atoms | 14 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 64632-44-6 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1O)O)C)O)CCN |
| InChIKey | XVCHFWOASRHNAW-UHFFFAOYSA-N |
Product Overview
5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol (CAS 64632-44-6), with molecular formula C10H15NO3 and molecular weight 197.11 g/mol. IUPAC: 5-(2-aminoethyl)-3,6-dimethylbenzene-1,2,4-triol.
Chemical Property Profile of 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol
Property Insights of 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol. Following Lipinski's Rule of Five, 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol has 4 hydrogen bond donor(s) and 4 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 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol?
The CAS number of 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol is 64632-44-6.
What is the molecular formula of 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol?
The molecular formula of 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol is C10H15NO3.
What is the molecular weight of 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol?
The molecular weight of 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol is 197.11 g/mol.
Where can I buy 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol?
You can request a quote for 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Aminoethyl)-3,6-dimethyl-1,2,4-benzenetriol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.