12H-009
TL;DR: 12H-009 (CAS 306977-37-7) is a chemical compound with molecular formula C19H8Cl4F3NO2 and molecular weight 478.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2,4-dichlorophenoxy)-5-(trifluoromethyl)-2-pyridinyl]-(2,4-dichlorophenyl)methanone
Also Known As: 12H-009, [3-(2,4-dichlorophenoxy)-5-(trifluoromethyl)-2-pyridinyl](2,4-dichlorophenyl)methanone, [3-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridin-2-yl]-(2,4-dichlorophenyl)methanone, 2-(2,4-dichlorobenzoyl)-3-(2,4-dichlorophenoxy)-5-(trifluoromethyl)pyridine
| Molecular Formula | C19H8Cl4F3NO2 |
|---|---|
| Molecular Weight | 478.93 g/mol |
| LogP | 7.7373 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 478.92612 |
| Heavy Atoms | 29 |
| Complexity | 1103.2977 |
Chemical Identifiers
| CAS Number | 306977-37-7 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)C(=O)C2=C(C=C(C=N2)C(F)(F)F)OC3=C(C=C(C=C3)Cl)Cl |
Product Overview
12H-009 (CAS 306977-37-7), with molecular formula C19H8Cl4F3NO2 and molecular weight 478.93 g/mol. IUPAC: [3-(2,4-dichlorophenoxy)-5-(trifluoromethyl)-2-pyridinyl]-(2,4-dichlorophenyl)methanone.
Chemical Property Profile of 12H-009
Property Insights of 12H-009
The XLogP value of 7.7373 indicates that 12H-009 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.19 Ų, 12H-009 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 12H-009 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 12H-009?
The CAS number of 12H-009 is 306977-37-7.
What is the molecular formula of 12H-009?
The molecular formula of 12H-009 is C19H8Cl4F3NO2.
What is the molecular weight of 12H-009?
The molecular weight of 12H-009 is 478.93 g/mol.
Where can I buy 12H-009?
You can request a quote for 12H-009 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 12H-009?
Yes, KEHONG BIO provides custom synthesis services for 12H-009 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.