![3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone structure](/static/products/5519/551930-77-9.webp)
3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone
TL;DR: 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone (CAS 551930-77-9) is a chemical compound with molecular formula C18H10Cl2F6N2O2 and molecular weight 470.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene]-3-methyloxetan-2-one
Also Known As: 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone, 3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]ethylidene]-3-methyloxetan-2-one
| Molecular Formula | C18H10Cl2F6N2O2 |
|---|---|
| Molecular Weight | 470.00 g/mol |
| LogP | 6.0667 |
| Topological Polar Surface Area | 52.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 470.00235 |
| Heavy Atoms | 30 |
| Complexity | 1081.3219 |
Chemical Identifiers
| CAS Number | 551930-77-9 |
|---|---|
| SMILES | CC(=C1C(C(=O)O1)(C)C2=C(C=C(C=N2)C(F)(F)F)Cl)C3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone (CAS 551930-77-9), with molecular formula C18H10Cl2F6N2O2 and molecular weight 470.00 g/mol. IUPAC: 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene]-3-methyloxetan-2-one.
Chemical Property Profile of 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone
Property Insights of 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone
The XLogP value of 6.0667 indicates that 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.08 Ų, 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone?
The CAS number of 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone is 551930-77-9.
What is the molecular formula of 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone?
The molecular formula of 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone is C18H10Cl2F6N2O2.
What is the molecular weight of 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone?
The molecular weight of 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone is 470.00 g/mol.
Where can I buy 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone?
You can request a quote for 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone?
Yes, KEHONG BIO provides custom synthesis services for 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-{(Z)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylidene}-3-methyl-2-oxetanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.