2-Methyldopamine
TL;DR: 2-Methyldopamine (CAS 53622-73-4) 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.
4-(2-aminoethyl)-3-methylbenzene-1,2-diol
Also Known As: 2-Methyldopamine, Methoxytyramine, 3-Methoxytyramine, Phenol,4-(2-aminoethyl)-2-methoxy-, 1,2-Benzenediol, 4-(2-aminoethyl)-3-methyl-
| Molecular Formula | C9H13NO2 |
|---|---|
| Molecular Weight | 167.09 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 167.09464 |
| Heavy Atoms | 12 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 53622-73-4 |
|---|---|
| SMILES | CC1=C(C=CC(=C1O)O)CCN |
| InChIKey | NSEVRAZZUOXAHQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methyldopamine (CAS 53622-73-4), with molecular formula C9H13NO2 and molecular weight 167.09 g/mol. IUPAC: 4-(2-aminoethyl)-3-methylbenzene-1,2-diol.
Chemical Property Profile of 2-Methyldopamine
Property Insights of 2-Methyldopamine
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyldopamine. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyldopamine. Following Lipinski's Rule of Five, 2-Methyldopamine has 3 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 2-Methyldopamine?
The CAS number of 2-Methyldopamine is 53622-73-4.
What is the molecular formula of 2-Methyldopamine?
The molecular formula of 2-Methyldopamine is C9H13NO2.
What is the molecular weight of 2-Methyldopamine?
The molecular weight of 2-Methyldopamine is 167.09 g/mol.
Where can I buy 2-Methyldopamine?
You can request a quote for 2-Methyldopamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyldopamine?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyldopamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.