4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline
TL;DR: 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline (CAS 238098-26-5) is a chemical compound with molecular formula C10H8F7N and molecular weight 275.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylaniline
Also Known As: 2-Methyl-4-(1,1,1,2,3,3,3-heptafluoro-2-propyl)aniline, 2-methyl-4-heptafluoroisopropylaniline, 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline, AMY305, 2-methyl-4-(heptafluoropropan-2-yl)-aniline
| Molecular Formula | C10H8F7N |
|---|---|
| Molecular Weight | 275.05 g/mol |
| LogP | 3.86662 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 275.0545 |
| Heavy Atoms | 18 |
| Complexity | 432.5199 |
Chemical Identifiers
| CAS Number | 238098-26-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)N |
Product Overview
4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline (CAS 238098-26-5), with molecular formula C10H8F7N and molecular weight 275.05 g/mol. IUPAC: 4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylaniline.
Chemical Property Profile of 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline
Property Insights of 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline
The XLogP value of 3.86662 indicates that 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline has 1 hydrogen bond donor(s) and 1 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 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline?
The CAS number of 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline is 238098-26-5.
What is the molecular formula of 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline?
The molecular formula of 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline is C10H8F7N.
What is the molecular weight of 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline?
The molecular weight of 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline is 275.05 g/mol.
Where can I buy 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline?
You can request a quote for 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.