Alpha-(4-iodoanilino)-ortho-cresol
TL;DR: Alpha-(4-iodoanilino)-ortho-cresol (CAS 13159-82-5) is a chemical compound with molecular formula C13H12INO and molecular weight 324.99637 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(4-iodoanilino)methyl]phenol
Also Known As: 2-[(4-iodoanilino)methyl]phenol, ALPHA-(4-IODOANILINO)-ORTHO-CRESOL, alpha-(p-Iodoanilino)-o-cresol, 2-(((4-Iodophenyl)amino)methyl)phenol, 2-{[(4-iodophenyl)amino]methyl}phenol
Technical Specifications
| Molecular Formula | C13H12INO |
| Molecular Weight | 324.99637 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.99637 Da |
| Heavy Atoms | 16 |
| Complexity | 204.0 |
| SMILES | C1=CC=C(C(=C1)CNC2=CC=C(C=C2)I)O |
| InChIKey | XULXYJODKHEBHB-UHFFFAOYSA-N |
Chemical Property Profile of Alpha-(4-iodoanilino)-ortho-cresol
Property Insights of Alpha-(4-iodoanilino)-ortho-cresol
The XLogP value of 3.7 indicates that Alpha-(4-iodoanilino)-ortho-cresol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, Alpha-(4-iodoanilino)-ortho-cresol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Alpha-(4-iodoanilino)-ortho-cresol 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 Alpha-(4-iodoanilino)-ortho-cresol?
The CAS number of Alpha-(4-iodoanilino)-ortho-cresol is 13159-82-5.
What is the molecular formula of Alpha-(4-iodoanilino)-ortho-cresol?
The molecular formula of Alpha-(4-iodoanilino)-ortho-cresol is C13H12INO.
What is the molecular weight of Alpha-(4-iodoanilino)-ortho-cresol?
The molecular weight of Alpha-(4-iodoanilino)-ortho-cresol is 324.99637 g/mol.
Where can I buy Alpha-(4-iodoanilino)-ortho-cresol?
You can request a quote for Alpha-(4-iodoanilino)-ortho-cresol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Alpha-(4-iodoanilino)-ortho-cresol?
Yes, CoreyChem provides custom synthesis services for Alpha-(4-iodoanilino)-ortho-cresol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.