3-Amino-4-(ethylamino)benzonitrile
TL;DR: 3-Amino-4-(ethylamino)benzonitrile (CAS 143174-02-1) is a chemical compound with molecular formula C9H11N3 and molecular weight 161.09529 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-amino-4-(ethylamino)benzonitrile
Also Known As: 3-amino-4-(ethylamino)benzonitrile, Benzonitrile,3-amino-4- -, 3-amino-4-ethylaminobenzonitrile, 3-amino-4-ethylamino-benzonitrile, benzonitrile,3-amino-4-(ethylamino)-
Technical Specifications
| Molecular Formula | C9H11N3 |
| Molecular Weight | 161.09529 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 161.09529 Da |
| Heavy Atoms | 12 |
| Complexity | 181.0 |
| SMILES | CCNC1=C(C=C(C=C1)C#N)N |
| InChIKey | WHLUSMYQBHWGSV-UHFFFAOYSA-N |
Chemical Property Profile of 3-Amino-4-(ethylamino)benzonitrile
Property Insights of 3-Amino-4-(ethylamino)benzonitrile
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-4-(ethylamino)benzonitrile. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-4-(ethylamino)benzonitrile. Following Lipinski's Rule of Five, 3-Amino-4-(ethylamino)benzonitrile 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
What is the CAS number of 3-Amino-4-(ethylamino)benzonitrile?
The CAS number of 3-Amino-4-(ethylamino)benzonitrile is 143174-02-1.
What is the molecular formula of 3-Amino-4-(ethylamino)benzonitrile?
The molecular formula of 3-Amino-4-(ethylamino)benzonitrile is C9H11N3.
What is the molecular weight of 3-Amino-4-(ethylamino)benzonitrile?
The molecular weight of 3-Amino-4-(ethylamino)benzonitrile is 161.09529 g/mol.
Where can I buy 3-Amino-4-(ethylamino)benzonitrile?
You can request a quote for 3-Amino-4-(ethylamino)benzonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Amino-4-(ethylamino)benzonitrile?
Yes, CoreyChem provides custom synthesis services for 3-Amino-4-(ethylamino)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.