Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro-
TL;DR: Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro- (CAS 35554-23-5) is a chemical compound with molecular formula C11H5Cl2F4NO3 and molecular weight 344.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-3-[chloro(difluoro)methyl]-4,4-difluoro-1-(3-nitrophenyl)but-2-en-1-one
Also Known As: CROTONOPHENONE, 4-CHLORO-3-CHLORODIFLUOROMETHYL-4,4-DIFLUORO-m-NITRO-, 4-Chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitrocrotonophenone, 4-Chloro-4,4-difluoro-3-(chlorodifluoro)methyl-1-(m-nitrophenyl)-2-buten-1-one, 4-chloro-3-(chlorodifluoromethyl)-4,4-difluoro-1-(3-nitrophenyl)but-2-en-1-one, 4-chloro-3-[chloro(difluoro)methyl]-4,4-difluoro-1-(3-nitrophenyl)but-2-en-1-one
| Molecular Formula | C11H5Cl2F4NO3 |
|---|---|
| Molecular Weight | 344.96 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.95825 |
| Heavy Atoms | 21 |
| Complexity | 449.0 |
Chemical Identifiers
| CAS Number | 35554-23-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C=C(C(F)(F)Cl)C(F)(F)Cl |
| InChIKey | DLYZTNGJNWYZHL-UHFFFAOYSA-N |
Product Overview
Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro- (CAS 35554-23-5), with molecular formula C11H5Cl2F4NO3 and molecular weight 344.96 g/mol. IUPAC: 4-chloro-3-[chloro(difluoro)methyl]-4,4-difluoro-1-(3-nitrophenyl)but-2-en-1-one.
Chemical Property Profile of Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro-
Property Insights of Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro-
The XLogP value of 4.4 indicates that Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro-. Following Lipinski's Rule of Five, Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro- has 0 hydrogen bond donor(s) and 7 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, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro-?
The CAS number of Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro- is 35554-23-5.
What is the molecular formula of Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro-?
The molecular formula of Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro- is C11H5Cl2F4NO3.
What is the molecular weight of Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro-?
The molecular weight of Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro- is 344.96 g/mol.
Where can I buy Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro-?
You can request a quote for Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Crotonophenone, 4-chloro-3-chlorodifluoromethyl-4,4-difluoro-m-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.