3-(1-Aminoethyl)aniline
TL;DR: 3-(1-Aminoethyl)aniline (CAS 1202057-39-3) is a chemical compound with molecular formula C8H12N2 and molecular weight 136.10005 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(1-aminoethyl)aniline
Also Known As: 3-(1-aminoethyl)aniline, 3-phenethylpyridine, 3-(1-Aminoethyl)benzenamine, 3-(1-AMINO-ETHYL)-PHENYLAMINE, 3-[(1S)-1-aminoethyl]aniline
Technical Specifications
| Molecular Formula | C8H12N2 |
| Molecular Weight | 136.10005 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 136.10005 Da |
| Heavy Atoms | 10 |
| Complexity | 103.0 |
| SMILES | CC(C1=CC(=CC=C1)N)N |
| InChIKey | MBWYRMCXWROJMP-UHFFFAOYSA-N |
Chemical Property Profile of 3-(1-Aminoethyl)aniline
Property Insights of 3-(1-Aminoethyl)aniline
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1-Aminoethyl)aniline. With a topological polar surface area (TPSA) of 52.0 Ų, 3-(1-Aminoethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-Aminoethyl)aniline 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 3-(1-Aminoethyl)aniline?
The CAS number of 3-(1-Aminoethyl)aniline is 1202057-39-3.
What is the molecular formula of 3-(1-Aminoethyl)aniline?
The molecular formula of 3-(1-Aminoethyl)aniline is C8H12N2.
What is the molecular weight of 3-(1-Aminoethyl)aniline?
The molecular weight of 3-(1-Aminoethyl)aniline is 136.10005 g/mol.
Where can I buy 3-(1-Aminoethyl)aniline?
You can request a quote for 3-(1-Aminoethyl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(1-Aminoethyl)aniline?
Yes, CoreyChem provides custom synthesis services for 3-(1-Aminoethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.