3,4-dimethoxy-N-methylphenethylamine hydrochloride
TL;DR: 3,4-dimethoxy-N-methylphenethylamine hydrochloride (CAS 13078-76-7) is a chemical compound with molecular formula C11H18ClNO2 and molecular weight 231.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-N-methylethanamine;hydrochloride
Also Known As: 3,4-Dimethoxy-N-methylphenethylamine hydrochloride, O,O-Dimethylepinine hydrochloride, timtec-bb sbb003268, Verapamil EP Impurity B HCl, N-Methylhomoveratrylamine hydrochloride
| Molecular Formula | C11H18ClNO2 |
|---|---|
| Molecular Weight | 231.10 g/mol |
| LogP | 1.8875 |
| Topological Polar Surface Area | 30.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 231.1026 |
| Heavy Atoms | 15 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 13078-76-7 |
|---|---|
| SMILES | CNCCC1=CC(=C(C=C1)OC)OC.Cl |
| InChIKey | BGEONUMCBIQUTQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-dimethoxy-N-methylphenethylamine hydrochloride (CAS 13078-76-7), with molecular formula C11H18ClNO2 and molecular weight 231.10 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-N-methylethanamine;hydrochloride.
Chemical Property Profile of 3,4-dimethoxy-N-methylphenethylamine hydrochloride
Property Insights of 3,4-dimethoxy-N-methylphenethylamine hydrochloride
The XLogP value of 1.8875 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-dimethoxy-N-methylphenethylamine hydrochloride. With a topological polar surface area (TPSA) of 30.5 Ų, 3,4-dimethoxy-N-methylphenethylamine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-dimethoxy-N-methylphenethylamine hydrochloride 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 3,4-dimethoxy-N-methylphenethylamine hydrochloride?
The CAS number of 3,4-dimethoxy-N-methylphenethylamine hydrochloride is 13078-76-7.
What is the molecular formula of 3,4-dimethoxy-N-methylphenethylamine hydrochloride?
The molecular formula of 3,4-dimethoxy-N-methylphenethylamine hydrochloride is C11H18ClNO2.
What is the molecular weight of 3,4-dimethoxy-N-methylphenethylamine hydrochloride?
The molecular weight of 3,4-dimethoxy-N-methylphenethylamine hydrochloride is 231.10 g/mol.
Where can I buy 3,4-dimethoxy-N-methylphenethylamine hydrochloride?
You can request a quote for 3,4-dimethoxy-N-methylphenethylamine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dimethoxy-N-methylphenethylamine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dimethoxy-N-methylphenethylamine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.