RefChem:1051670
TL;DR: RefChem:1051670 (CAS 100991-90-0) is a chemical compound with molecular formula C19H14Cl2F7NO3 and molecular weight 507.0239 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1,1,1-trifluoro-4-(4-fluorophenyl)-4-hydroxy-3-methyl-2-(trifluoromethyl)butan-2-yl] N-(3,4-dichlorophenyl)carbamate
Also Known As: [1,1,1-trifluoro-4-(4-fluorophenyl)-4-hydroxy-3-methyl-2-(trifluoromethyl)butan-2-yl] N-(3,4-dichlorophenyl)carbamate, 1,3-Butanediol, 1-(p-fluorophenyl)-2-methyl-4,4,4-trifluoro-3-(trifluoromethyl)-, 3,4-dichlorocarbanilate, 1,1,1-Trifluoro-4-(4-fluorophenyl)-4-hydroxy-3-methyl-2-(trifluoromethyl)butan-2-yl hydrogen (3,4-dichlorophenyl)carbonimidate, 1,3-BUTANEDIOL, 1-(p-FLUOROPHENYL)-2-METHYL-4,4,4-TRIFLUORO-3-(TRIFLUOROMETHYL)-, [1,1,1-Trifluoro-4-(4-fluorophenyl)-4-hydroxy-3-methyl-2-(trifluoromethyl)butan-2-yl]n-(3,4-dichlorophenyl)carbamate
Technical Specifications
| Molecular Formula | C19H14Cl2F7NO3 |
| Molecular Weight | 507.0239 g/mol |
| XLogP | 6.6 |
| Topological Polar Surface Area (TPSA) | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 507.0239 Da |
| Heavy Atoms | 32 |
| Complexity | 627.0 |
| SMILES | CC(C(C1=CC=C(C=C1)F)O)C(C(F)(F)F)(C(F)(F)F)OC(=O)NC2=CC(=C(C=C2)Cl)Cl |
| InChIKey | DYNXBYHYGGWRKH-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1051670
Property Insights of RefChem:1051670
The XLogP value of 6.6 indicates that RefChem:1051670 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.6 Ų, RefChem:1051670 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1051670 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:1051670?
The CAS number of RefChem:1051670 is 100991-90-0.
What is the molecular formula of RefChem:1051670?
The molecular formula of RefChem:1051670 is C19H14Cl2F7NO3.
What is the molecular weight of RefChem:1051670?
The molecular weight of RefChem:1051670 is 507.0239 g/mol.
Where can I buy RefChem:1051670?
You can request a quote for RefChem:1051670 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1051670?
Yes, CoreyChem provides custom synthesis services for RefChem:1051670 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.