1-(Methylseleno)-4-(trifluoromethyl)benzene
TL;DR: 1-(Methylseleno)-4-(trifluoromethyl)benzene (CAS 107010-66-2) is a chemical compound with molecular formula C8H7F3Se and molecular weight 239.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylselanyl-4-(trifluoromethyl)benzene
Also Known As: methyl(4-(trifluoromethyl)phenyl)selane, Methyl(4-trifluoromethylphenyl) selenide, 1-(methylseleno)-4-(trifluoromethyl)benzene, 1-methylselanyl-4-(trifluoromethyl)benzene, 1-(methylselanyl)-4-(trifluoromethyl)benzene
| Molecular Formula | C8H7F3Se |
|---|---|
| Molecular Weight | 239.97 g/mol |
| LogP | 2.083 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.9665 |
| Heavy Atoms | 12 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 107010-66-2 |
|---|---|
| SMILES | C[Se]C1=CC=C(C=C1)C(F)(F)F |
| InChIKey | JPVXCFCSTUIEHK-UHFFFAOYSA-N |
Product Overview
1-(Methylseleno)-4-(trifluoromethyl)benzene (CAS 107010-66-2), with molecular formula C8H7F3Se and molecular weight 239.97 g/mol. IUPAC: 1-methylselanyl-4-(trifluoromethyl)benzene.
Chemical Property Profile of 1-(Methylseleno)-4-(trifluoromethyl)benzene
Property Insights of 1-(Methylseleno)-4-(trifluoromethyl)benzene
The XLogP value of 2.083 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Methylseleno)-4-(trifluoromethyl)benzene. With a topological polar surface area (TPSA) of 0.0 Ų, 1-(Methylseleno)-4-(trifluoromethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Methylseleno)-4-(trifluoromethyl)benzene has 0 hydrogen bond donor(s) and 3 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 1-(Methylseleno)-4-(trifluoromethyl)benzene?
The CAS number of 1-(Methylseleno)-4-(trifluoromethyl)benzene is 107010-66-2.
What is the molecular formula of 1-(Methylseleno)-4-(trifluoromethyl)benzene?
The molecular formula of 1-(Methylseleno)-4-(trifluoromethyl)benzene is C8H7F3Se.
What is the molecular weight of 1-(Methylseleno)-4-(trifluoromethyl)benzene?
The molecular weight of 1-(Methylseleno)-4-(trifluoromethyl)benzene is 239.97 g/mol.
Where can I buy 1-(Methylseleno)-4-(trifluoromethyl)benzene?
You can request a quote for 1-(Methylseleno)-4-(trifluoromethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Methylseleno)-4-(trifluoromethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(Methylseleno)-4-(trifluoromethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.