3-甲氧基酪胺
TL;DR: 3-甲氧基酪胺 (CAS 554-52-9) is a chemical compound with molecular formula C9H13NO2 and molecular weight 167.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-甲氧基酪胺
4-(2-aminoethyl)-2-methoxyphenol
Also Known As: 3-Methoxytyramine, 4-(2-Aminoethyl)-2-methoxyphenol, Methoxytyramine, 4-(2-Amino-ethyl)-2-methoxy-phenol, 3-O-methyldopamine
| Molecular Formula | C9H13NO2 |
|---|---|
| Molecular Weight | 167.09 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 55.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 167.09464 |
| Heavy Atoms | 12 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 554-52-9 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)CCN)O |
| InChIKey | DIVQKHQLANKJQO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-甲氧基酪胺 (CAS 554-52-9), with molecular formula C9H13NO2 and molecular weight 167.09 g/mol. IUPAC: 4-(2-aminoethyl)-2-methoxyphenol.
Chemical Property Profile of 3-甲氧基酪胺
Property Insights of 3-甲氧基酪胺
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-甲氧基酪胺. With a topological polar surface area (TPSA) of 55.5 Ų, 3-甲氧基酪胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-甲氧基酪胺 has 2 hydrogen bond donor(s) and 3 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 3-甲氧基酪胺?
The CAS number of 3-甲氧基酪胺 is 554-52-9.
What is the molecular formula of 3-甲氧基酪胺?
The molecular formula of 3-甲氧基酪胺 is C9H13NO2.
What is the molecular weight of 3-甲氧基酪胺?
The molecular weight of 3-甲氧基酪胺 is 167.09 g/mol.
Where can I buy 3-甲氧基酪胺?
You can request a quote for 3-甲氧基酪胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-甲氧基酪胺?
Yes, KEHONG BIO provides custom synthesis services for 3-甲氧基酪胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.