3-Iodobenzyloxybenzene
TL;DR: 3-Iodobenzyloxybenzene (CAS 107623-21-2) is a chemical compound with molecular formula C13H11IO and molecular weight 309.98547 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-iodo-3-phenylmethoxybenzene
Also Known As: 1-(Benzyloxy)-3-iodobenzene, 3-Iodobenzyloxybenzene, 1-Benzyloxy-3-Iodobenzene, 1-iodo-3-phenylmethoxybenzene, 3-Benzyloxyiodobenzene
Technical Specifications
| Molecular Formula | C13H11IO |
| Molecular Weight | 309.98547 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.98547 Da |
| Heavy Atoms | 15 |
| Complexity | 177.0 |
| SMILES | C1=CC=C(C=C1)COC2=CC(=CC=C2)I |
| InChIKey | QMKHOPJXDQAHBG-UHFFFAOYSA-N |
Chemical Property Profile of 3-Iodobenzyloxybenzene
Property Insights of 3-Iodobenzyloxybenzene
The XLogP value of 4.3 indicates that 3-Iodobenzyloxybenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 3-Iodobenzyloxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Iodobenzyloxybenzene has 0 hydrogen bond donor(s) and 1 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-Iodobenzyloxybenzene?
The CAS number of 3-Iodobenzyloxybenzene is 107623-21-2.
What is the molecular formula of 3-Iodobenzyloxybenzene?
The molecular formula of 3-Iodobenzyloxybenzene is C13H11IO.
What is the molecular weight of 3-Iodobenzyloxybenzene?
The molecular weight of 3-Iodobenzyloxybenzene is 309.98547 g/mol.
Where can I buy 3-Iodobenzyloxybenzene?
You can request a quote for 3-Iodobenzyloxybenzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Iodobenzyloxybenzene?
Yes, CoreyChem provides custom synthesis services for 3-Iodobenzyloxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.