2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol
TL;DR: 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol (CAS 13079-18-0) is a chemical compound with molecular formula C11H17NO4 and molecular weight 227.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-(3,4,5-trimethoxyphenyl)ethanol
Also Known As: 2-amino-1-(3,4,5-trimethoxyphenyl)ethanol, beta-Hydroxymescaline hydrochloride, O(C)c1c(OC)cc(cc1OC)C(O)CN, 2-amino-1-(3,4,5-trimethoxyphenyl)ethan-1-ol, Benzenemethanol, alpha-(aminomethyl)-3,4,5-trimethoxy-
| Molecular Formula | C11H17NO4 |
|---|---|
| Molecular Weight | 227.12 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 73.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 227.11575 |
| Heavy Atoms | 16 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 13079-18-0 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(CN)O |
| InChIKey | BHURFCFBOPXSCN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol (CAS 13079-18-0), with molecular formula C11H17NO4 and molecular weight 227.12 g/mol. IUPAC: 2-amino-1-(3,4,5-trimethoxyphenyl)ethanol.
Chemical Property Profile of 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol
Property Insights of 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol
The XLogP value of -0.3 indicates that 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 73.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol. Following Lipinski's Rule of Five, 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol has 2 hydrogen bond donor(s) and 5 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-Amino-1-(3,4,5-trimethoxyphenyl)ethanol?
The CAS number of 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol is 13079-18-0.
What is the molecular formula of 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol?
The molecular formula of 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol is C11H17NO4.
What is the molecular weight of 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol?
The molecular weight of 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol is 227.12 g/mol.
Where can I buy 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol?
You can request a quote for 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-1-(3,4,5-trimethoxyphenyl)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.