Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl-
TL;DR: Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl- (CAS 101030-73-3) is a chemical compound with molecular formula C11H5F7O3S and molecular weight 349.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4,4,4-trifluoro-3-(trifluoromethyl)but-2-enoyl]benzenesulfonyl fluoride
Also Known As: CROTONOPHENONE, 3'-FLUOROSULFONYL-4,4,4-TRIFLUORO-3-TRIFLUOROMETHYL-, m-(4,4,4-Trifluoro-3-trifluoromethylcrotonyl) benzene-sulfonylfluoride, 3'-Fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethylcrotonophenone, 3-[4,4,4-trifluoro-3-(trifluoromethyl)but-2-enoyl]benzene-1-sulfonyl fluoride, Benzenesulfonyl fluoride, 3-[4,4,4-trifluoro-1-oxo-3-(trifluoromethyl)-2-buten-1-yl]-
| Molecular Formula | C11H5F7O3S |
|---|---|
| Molecular Weight | 349.98 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 59.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 349.98477 |
| Heavy Atoms | 22 |
| Complexity | 538.0 |
Chemical Identifiers
| CAS Number | 101030-73-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)F)C(=O)C=C(C(F)(F)F)C(F)(F)F |
| InChIKey | QJPKZBQTZLBBJX-UHFFFAOYSA-N |
Product Overview
Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl- (CAS 101030-73-3), with molecular formula C11H5F7O3S and molecular weight 349.98 g/mol. IUPAC: 3-[4,4,4-trifluoro-3-(trifluoromethyl)but-2-enoyl]benzenesulfonyl fluoride.
Chemical Property Profile of Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl-
Property Insights of Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl-
The XLogP value of 3.9 indicates that Crotonophenone, 3'-fluorosulfonyl-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 59.6 Ų, Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl- has 0 hydrogen bond donor(s) and 10 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 Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl-?
The CAS number of Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl- is 101030-73-3.
What is the molecular formula of Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl-?
The molecular formula of Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl- is C11H5F7O3S.
What is the molecular weight of Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl-?
The molecular weight of Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl- is 349.98 g/mol.
Where can I buy Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl-?
You can request a quote for Crotonophenone, 3'-fluorosulfonyl-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 Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl-?
Yes, KEHONG BIO provides custom synthesis services for Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.