![2-[(Heptafluoropropyl)sulfanyl]aniline structure](/static/products/1663/166392-11-6.webp)
2-[(Heptafluoropropyl)sulfanyl]aniline
TL;DR: 2-[(Heptafluoropropyl)sulfanyl]aniline (CAS 166392-11-6) is a chemical compound with molecular formula C9H6F7NS and molecular weight 293.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,1,2,2,3,3,3-heptafluoropropylsulfanyl)aniline
Also Known As: 2-[(heptafluoropropyl)sulfanyl]aniline, 2-(Heptafluoropropylthio)aniline, 2-Heptafluoropropylsulfanyl-phenylamine, 2-((perfluoropropyl)thio)aniline, 2-(heptafluoropropyl)sulfanylaniline
| Molecular Formula | C9H6F7NS |
|---|---|
| Molecular Weight | 293.01 g/mol |
| LogP | 4.1513 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.01093 |
| Heavy Atoms | 18 |
| Complexity | 429.1695 |
Chemical Identifiers
| CAS Number | 166392-11-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)N)SC(C(C(F)(F)F)(F)F)(F)F |
Product Overview
2-[(Heptafluoropropyl)sulfanyl]aniline (CAS 166392-11-6), with molecular formula C9H6F7NS and molecular weight 293.01 g/mol. IUPAC: 2-(1,1,2,2,3,3,3-heptafluoropropylsulfanyl)aniline.
Chemical Property Profile of 2-[(Heptafluoropropyl)sulfanyl]aniline
Property Insights of 2-[(Heptafluoropropyl)sulfanyl]aniline
The XLogP value of 4.1513 indicates that 2-[(Heptafluoropropyl)sulfanyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, 2-[(Heptafluoropropyl)sulfanyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(Heptafluoropropyl)sulfanyl]aniline has 1 hydrogen bond donor(s) and 2 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 2-[(Heptafluoropropyl)sulfanyl]aniline?
The CAS number of 2-[(Heptafluoropropyl)sulfanyl]aniline is 166392-11-6.
What is the molecular formula of 2-[(Heptafluoropropyl)sulfanyl]aniline?
The molecular formula of 2-[(Heptafluoropropyl)sulfanyl]aniline is C9H6F7NS.
What is the molecular weight of 2-[(Heptafluoropropyl)sulfanyl]aniline?
The molecular weight of 2-[(Heptafluoropropyl)sulfanyl]aniline is 293.01 g/mol.
Where can I buy 2-[(Heptafluoropropyl)sulfanyl]aniline?
You can request a quote for 2-[(Heptafluoropropyl)sulfanyl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Heptafluoropropyl)sulfanyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Heptafluoropropyl)sulfanyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.