N1-Methyl-1-phenylethylenediamine
TL;DR: N1-Methyl-1-phenylethylenediamine (CAS 66308-14-3) is a chemical compound with molecular formula C9H14N2 and molecular weight 150.11569 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-methyl-1-phenylethane-1,2-diamine
Also Known As: N1-Methyl-1-phenylethylenediamine, N-Methyl-1-phenylethylenediamine, N-methyl-1-phenylethane-1,2-diamine, N1-methyl-1-phenyl-1,2-ethanediamine, N1-Methyl-1-phenyl-aethandiyldiamin
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H14N2 |
| Molecular Weight | 150.11569 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 38.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 150.11569 Da |
| Heavy Atoms | 11 |
| Complexity | 97.0 |
| SMILES | CNC(CN)C1=CC=CC=C1 |
| InChIKey | PSWHCXOXDHWTEE-UHFFFAOYSA-N |
Chemical Property Profile of N1-Methyl-1-phenylethylenediamine
Property Insights of N1-Methyl-1-phenylethylenediamine
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-Methyl-1-phenylethylenediamine. With a topological polar surface area (TPSA) of 38.1 Ų, N1-Methyl-1-phenylethylenediamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1-Methyl-1-phenylethylenediamine has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N1-Methyl-1-phenylethylenediamine?
The CAS number of N1-Methyl-1-phenylethylenediamine is 66308-14-3.
What is the molecular formula of N1-Methyl-1-phenylethylenediamine?
The molecular formula of N1-Methyl-1-phenylethylenediamine is C9H14N2.
What is the molecular weight of N1-Methyl-1-phenylethylenediamine?
The molecular weight of N1-Methyl-1-phenylethylenediamine is 150.11569 g/mol.
Where can I buy N1-Methyl-1-phenylethylenediamine?
You can request a quote for N1-Methyl-1-phenylethylenediamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N1-Methyl-1-phenylethylenediamine?
Yes, CoreyChem provides custom synthesis services for N1-Methyl-1-phenylethylenediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.