Phenethylamine, m,alpha-dimethyl-, sulfate (2:1)
TL;DR: Phenethylamine, m,alpha-dimethyl-, sulfate (2:1) (CAS 64057-74-5) is a chemical compound with molecular formula C20H32N2O4S and molecular weight 396.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(1-(3-methylphenyl)propan-2-amine);sulfuric acid
Also Known As: 3-Methylphenisopropylamine sulfate, KST-1B7058, 1-(3-methylphenyl)propan-2-amine sulfate(2:1), Phenethylamine, m,alpha-dimethyl-, sulfate (2:1), C10-H15-N.1/2H2-O4-S
| Molecular Formula | C20H32N2O4S |
|---|---|
| Molecular Weight | 396.21 g/mol |
| LogP | 3.12 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.20828 |
| Heavy Atoms | 27 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 64057-74-5 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CC(C)N.CC1=CC(=CC=C1)CC(C)N.OS(=O)(=O)O |
| InChIKey | MJYHJCGMKVDERQ-UHFFFAOYSA-N |
Product Overview
Phenethylamine, m,alpha-dimethyl-, sulfate (2:1) (CAS 64057-74-5), with molecular formula C20H32N2O4S and molecular weight 396.21 g/mol. IUPAC: bis(1-(3-methylphenyl)propan-2-amine);sulfuric acid.
Chemical Property Profile of Phenethylamine, m,alpha-dimethyl-, sulfate (2:1)
Property Insights of Phenethylamine, m,alpha-dimethyl-, sulfate (2:1)
The XLogP value of 3.12 indicates that Phenethylamine, m,alpha-dimethyl-, sulfate (2:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenethylamine, m,alpha-dimethyl-, sulfate (2:1). Following Lipinski's Rule of Five, Phenethylamine, m,alpha-dimethyl-, sulfate (2:1) has 4 hydrogen bond donor(s) and 6 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 Phenethylamine, m,alpha-dimethyl-, sulfate (2:1)?
The CAS number of Phenethylamine, m,alpha-dimethyl-, sulfate (2:1) is 64057-74-5.
What is the molecular formula of Phenethylamine, m,alpha-dimethyl-, sulfate (2:1)?
The molecular formula of Phenethylamine, m,alpha-dimethyl-, sulfate (2:1) is C20H32N2O4S.
What is the molecular weight of Phenethylamine, m,alpha-dimethyl-, sulfate (2:1)?
The molecular weight of Phenethylamine, m,alpha-dimethyl-, sulfate (2:1) is 396.21 g/mol.
Where can I buy Phenethylamine, m,alpha-dimethyl-, sulfate (2:1)?
You can request a quote for Phenethylamine, m,alpha-dimethyl-, sulfate (2:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenethylamine, m,alpha-dimethyl-, sulfate (2:1)?
Yes, KEHONG BIO provides custom synthesis services for Phenethylamine, m,alpha-dimethyl-, sulfate (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.