2-Amino-5-iodobenzonitrile
TL;DR: 2-Amino-5-iodobenzonitrile (CAS 132131-24-9) is a chemical compound with molecular formula C7H5IN2 and molecular weight 243.94975 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-5-iodobenzonitrile
Also Known As: 2-Amino-5-iodobenzonitrile, Benzonitrile, 2-amino-5-iodo-, 2-amino-5-iodo-benzonitrile, 2-cyano-4-iodoaniline, 5937AA
Technical Specifications
| Molecular Formula | C7H5IN2 |
| Molecular Weight | 243.94975 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 243.94975 Da |
| Heavy Atoms | 10 |
| Complexity | 160.0 |
| SMILES | C1=CC(=C(C=C1I)C#N)N |
| InChIKey | PRIOKVMBFXTMRV-UHFFFAOYSA-N |
Chemical Property Profile of 2-Amino-5-iodobenzonitrile
Property Insights of 2-Amino-5-iodobenzonitrile
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-5-iodobenzonitrile. With a topological polar surface area (TPSA) of 49.8 Ų, 2-Amino-5-iodobenzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Amino-5-iodobenzonitrile has 1 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 2-Amino-5-iodobenzonitrile?
The CAS number of 2-Amino-5-iodobenzonitrile is 132131-24-9.
What is the molecular formula of 2-Amino-5-iodobenzonitrile?
The molecular formula of 2-Amino-5-iodobenzonitrile is C7H5IN2.
What is the molecular weight of 2-Amino-5-iodobenzonitrile?
The molecular weight of 2-Amino-5-iodobenzonitrile is 243.94975 g/mol.
Where can I buy 2-Amino-5-iodobenzonitrile?
You can request a quote for 2-Amino-5-iodobenzonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Amino-5-iodobenzonitrile?
Yes, CoreyChem provides custom synthesis services for 2-Amino-5-iodobenzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.