(E)-4-iodo-3-methylbut-3-en-1-ol
TL;DR: (E)-4-iodo-3-methylbut-3-en-1-ol (CAS 78592-73-1) is a chemical compound with molecular formula C5H9IO and molecular weight 211.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-iodo-3-methylbut-3-en-1-ol
Also Known As: (E)-4-iodo-3-methylbut-3-en-1-ol, 4-iodo-3-methylbut-3-en-1-ol, 3-Methyl-4-iodo-3-butene-1-ol, (E)-3-Methyl-4-iodo-3-butene-1-ol, (3E)-4-iodo-3-methyl-3-buten-1-ol
| Molecular Formula | C5H9IO |
|---|---|
| Molecular Weight | 211.97 g/mol |
| LogP | 1.7076 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.9698 |
| Heavy Atoms | 7 |
| Complexity | 68.48041 |
Chemical Identifiers
| CAS Number | 78592-73-1 |
|---|---|
| SMILES | C/C(=C\I)/CCO |
Product Overview
(E)-4-iodo-3-methylbut-3-en-1-ol (CAS 78592-73-1), with molecular formula C5H9IO and molecular weight 211.97 g/mol. IUPAC: (E)-4-iodo-3-methylbut-3-en-1-ol.
Chemical Property Profile of (E)-4-iodo-3-methylbut-3-en-1-ol
Property Insights of (E)-4-iodo-3-methylbut-3-en-1-ol
The XLogP value of 1.7076 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-4-iodo-3-methylbut-3-en-1-ol. With a topological polar surface area (TPSA) of 20.23 Ų, (E)-4-iodo-3-methylbut-3-en-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-4-iodo-3-methylbut-3-en-1-ol has 1 hydrogen bond donor(s) and 1 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 (E)-4-iodo-3-methylbut-3-en-1-ol?
The CAS number of (E)-4-iodo-3-methylbut-3-en-1-ol is 78592-73-1.
What is the molecular formula of (E)-4-iodo-3-methylbut-3-en-1-ol?
The molecular formula of (E)-4-iodo-3-methylbut-3-en-1-ol is C5H9IO.
What is the molecular weight of (E)-4-iodo-3-methylbut-3-en-1-ol?
The molecular weight of (E)-4-iodo-3-methylbut-3-en-1-ol is 211.97 g/mol.
Where can I buy (E)-4-iodo-3-methylbut-3-en-1-ol?
You can request a quote for (E)-4-iodo-3-methylbut-3-en-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-iodo-3-methylbut-3-en-1-ol?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-iodo-3-methylbut-3-en-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.