1-Phenethylamine
TL;DR: 1-Phenethylamine (CAS 618-36-0) is a chemical compound with molecular formula C8H11N and molecular weight 121.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylethanamine
Also Known As: 1-Phenylethanamine, 1-Phenylethylamine, ALPHA-METHYLBENZYLAMINE, alpha-Phenylethylamine, 1-Phenethylamine
| Molecular Formula | C8H11N |
|---|---|
| Molecular Weight | 121.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 121.08915 |
| Heavy Atoms | 9 |
| Complexity | 74.0 |
| Melting Point | -65 °C |
| Boiling Point | 188.5 °C |
| Density | 0.9535 @ 20 °C/20 °C |
| Solubility | SOL IN MOST ORG SOLVENTS & HYDROCARBONS |
| Flash Point | 79.4 °C |
| Vapor Pressure | 0.5 [mmHg] |
| Refractive Index | 1.5238 @ 25 °C; SADTLER REFERENCE NUMBER: 5859 (IR, PRISM); 8420 (IR, GRATING); 1640 (UV); 207 (NMR, VARIAN) /DL-FORM/ |
Chemical Identifiers
| CAS Number | 618-36-0 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)N |
| InChIKey | RQEUFEKYXDPUSK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenethylamine (CAS 618-36-0), with molecular formula C8H11N and molecular weight 121.09 g/mol. IUPAC: 1-phenylethanamine.
Chemical Property Profile of 1-Phenethylamine
Property Insights of 1-Phenethylamine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenethylamine. With a topological polar surface area (TPSA) of 26.0 Ų, 1-Phenethylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenethylamine has 1 hydrogen bond donor(s) and 1 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 1-Phenethylamine?
The CAS number of 1-Phenethylamine is 618-36-0.
What is the molecular formula of 1-Phenethylamine?
The molecular formula of 1-Phenethylamine is C8H11N.
What is the molecular weight of 1-Phenethylamine?
The molecular weight of 1-Phenethylamine is 121.09 g/mol.
Where can I buy 1-Phenethylamine?
You can request a quote for 1-Phenethylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenethylamine?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenethylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.