![4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol structure](/static/products/927/92712-44-2.png)
4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol
TL;DR: 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol (CAS 92712-44-2) is a chemical compound with molecular formula C10H7IN4O and molecular weight 325.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(3-iodoprop-2-ynyl)tetrazol-5-yl]phenol
Also Known As: 4-[2-(3-iodoprop-2-ynyl)tetrazol-5-yl]phenol, 2-(1'-iodopropyn-3'-yl)-5-(p-hydroxyphenyl)tetrazole, Phenol, 4-[2-(3-iodo-2-propynyl)-2H-tetrazol-5-yl]-, 4-[2-(3-iodoprop-2-ynyl)-1H-tetrazol-5-ylidene]cyclohexa-2,5-dien-1-one
| Molecular Formula | C10H7IN4O |
|---|---|
| Molecular Weight | 325.97 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 63.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 325.96646 |
| Heavy Atoms | 16 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 92712-44-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NN(N=N2)CC#CI)O |
| InChIKey | DJDLKVXWRVBMMM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol (CAS 92712-44-2), with molecular formula C10H7IN4O and molecular weight 325.97 g/mol. IUPAC: 4-[2-(3-iodoprop-2-ynyl)tetrazol-5-yl]phenol.
Chemical Property Profile of 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol
Property Insights of 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol. The TPSA of 63.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol. Following Lipinski's Rule of Five, 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol has 1 hydrogen bond donor(s) and 4 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 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol?
The CAS number of 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol is 92712-44-2.
What is the molecular formula of 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol?
The molecular formula of 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol is C10H7IN4O.
What is the molecular weight of 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol?
The molecular weight of 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol is 325.97 g/mol.
Where can I buy 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol?
You can request a quote for 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-(3-Iodoprop-2-ynyl)tetrazol-5-yl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.