2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl-
TL;DR: 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl- (CAS 100482-67-5) is a chemical compound with molecular formula C16H6F12O2 and molecular weight 458.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,4-trifluoro-3-(trifluoromethyl)-1-[4-[4,4,4-trifluoro-3-(trifluoromethyl)but-2-enoyl]phenyl]but-2-en-1-one
Also Known As: 2-BUTEN-1-ONE, 1,1'-p-PHENYLENEBIS(4,4,4-TRIFLUORO-3-TRIFLUOROMETHYL-, 1,1'-Phenylenebis(4,4,4-trifluoro-3-trifluoromethyl-2-buten-1-one), 1,1 -p-Phenylenebis(4,4,4-trifluoro-3-trifluoromethyl-2-buten-1-one), 1,1'-(1,4-Phenylene)bis[4,4,4-trifluoro-3-(trifluoromethyl)but-2-en-1-one], 1,1'-benzene-1,4-diylbis[4,4,4-trifluoro-3-(trifluoromethyl)but-2-en-1-one]
| Molecular Formula | C16H6F12O2 |
|---|---|
| Molecular Weight | 458.02 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 4 |
| Exact Mass | 458.0176 |
| Heavy Atoms | 30 |
| Complexity | 616.0 |
Chemical Identifiers
| CAS Number | 100482-67-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)C=C(C(F)(F)F)C(F)(F)F)C(=O)C=C(C(F)(F)F)C(F)(F)F |
| InChIKey | GRSGIVXJQSIXLR-UHFFFAOYSA-N |
Product Overview
2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl- (CAS 100482-67-5), with molecular formula C16H6F12O2 and molecular weight 458.02 g/mol. IUPAC: 4,4,4-trifluoro-3-(trifluoromethyl)-1-[4-[4,4,4-trifluoro-3-(trifluoromethyl)but-2-enoyl]phenyl]but-2-en-1-one.
Chemical Property Profile of 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl-
Property Insights of 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl-
The XLogP value of 6.3 indicates that 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl- has 0 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl-?
The CAS number of 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl- is 100482-67-5.
What is the molecular formula of 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl-?
The molecular formula of 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl- is C16H6F12O2.
What is the molecular weight of 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl-?
The molecular weight of 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl- is 458.02 g/mol.
Where can I buy 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl-?
You can request a quote for 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Buten-1-one, 1,1'-p-phenylenebis(4,4,4-trifluoro-3-trifluoromethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.