1-Iodo-2-isocyanobenzene
TL;DR: 1-Iodo-2-isocyanobenzene (CAS 183209-25-8) is a chemical compound with molecular formula C7H4IN and molecular weight 228.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-iodo-2-isocyanobenzene
Also Known As: 1-iodo-2-isocyanobenzene, 2-iodophenyl isocyanide, 2-Iodophenylisocyanide, 1-iodo-2-isocyano-benzene, (2-Iodophenyl) isocyanide
| Molecular Formula | C7H4IN |
|---|---|
| Molecular Weight | 228.94 g/mol |
| LogP | 2.84199 |
| Topological Polar Surface Area | 4.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 228.93884 |
| Heavy Atoms | 9 |
| Complexity | 249.33821 |
Chemical Identifiers
| CAS Number | 183209-25-8 |
|---|---|
| SMILES | [C-]#[N+]C1=CC=CC=C1I |
Product Overview
1-Iodo-2-isocyanobenzene (CAS 183209-25-8), with molecular formula C7H4IN and molecular weight 228.94 g/mol. IUPAC: 1-iodo-2-isocyanobenzene.
Chemical Property Profile of 1-Iodo-2-isocyanobenzene
Property Insights of 1-Iodo-2-isocyanobenzene
The XLogP value of 2.84199 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Iodo-2-isocyanobenzene. With a topological polar surface area (TPSA) of 4.36 Ų, 1-Iodo-2-isocyanobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Iodo-2-isocyanobenzene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Iodo-2-isocyanobenzene?
The CAS number of 1-Iodo-2-isocyanobenzene is 183209-25-8.
What is the molecular formula of 1-Iodo-2-isocyanobenzene?
The molecular formula of 1-Iodo-2-isocyanobenzene is C7H4IN.
What is the molecular weight of 1-Iodo-2-isocyanobenzene?
The molecular weight of 1-Iodo-2-isocyanobenzene is 228.94 g/mol.
Where can I buy 1-Iodo-2-isocyanobenzene?
You can request a quote for 1-Iodo-2-isocyanobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Iodo-2-isocyanobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Iodo-2-isocyanobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.