(E)-1,1,1-trifluoro-3-iodobut-2-ene
TL;DR: (E)-1,1,1-trifluoro-3-iodobut-2-ene (CAS 406-53-1) is a chemical compound with molecular formula C4H4F3I and molecular weight 235.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1,1,1-trifluoro-3-iodobut-2-ene
Also Known As: KAx@PAVUHMH]HIL}SUPIH, (E)-1,1,1-trifluoro-3-iodobut-2-ene, 2-Iodo-4,4,4-trifluorobut-2-ene, 1,1,1-trifluoro-3-iodobut-2-ene, (2E)-1,1,1-trifluoro-3-iodobut-2-ene
| Molecular Formula | C4H4F3I |
|---|---|
| Molecular Weight | 235.93 g/mol |
| LogP | 2.8875 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 235.93098 |
| Heavy Atoms | 8 |
| Complexity | 98.34128 |
Chemical Identifiers
| CAS Number | 406-53-1 |
|---|---|
| SMILES | C/C(=C\C(F)(F)F)/I |
Product Overview
(E)-1,1,1-trifluoro-3-iodobut-2-ene (CAS 406-53-1), with molecular formula C4H4F3I and molecular weight 235.93 g/mol. IUPAC: (E)-1,1,1-trifluoro-3-iodobut-2-ene.
Chemical Property Profile of (E)-1,1,1-trifluoro-3-iodobut-2-ene
Property Insights of (E)-1,1,1-trifluoro-3-iodobut-2-ene
The XLogP value of 2.8875 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1,1,1-trifluoro-3-iodobut-2-ene. With a topological polar surface area (TPSA) of 0.0 Ų, (E)-1,1,1-trifluoro-3-iodobut-2-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-1,1,1-trifluoro-3-iodobut-2-ene 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 (E)-1,1,1-trifluoro-3-iodobut-2-ene?
The CAS number of (E)-1,1,1-trifluoro-3-iodobut-2-ene is 406-53-1.
What is the molecular formula of (E)-1,1,1-trifluoro-3-iodobut-2-ene?
The molecular formula of (E)-1,1,1-trifluoro-3-iodobut-2-ene is C4H4F3I.
What is the molecular weight of (E)-1,1,1-trifluoro-3-iodobut-2-ene?
The molecular weight of (E)-1,1,1-trifluoro-3-iodobut-2-ene is 235.93 g/mol.
Where can I buy (E)-1,1,1-trifluoro-3-iodobut-2-ene?
You can request a quote for (E)-1,1,1-trifluoro-3-iodobut-2-ene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-1,1,1-trifluoro-3-iodobut-2-ene?
Yes, KEHONG BIO provides custom synthesis services for (E)-1,1,1-trifluoro-3-iodobut-2-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.