2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride
TL;DR: 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride (CAS 473574-83-3) is a chemical compound with molecular formula C10H13ClF3NO and molecular weight 255.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propan-2-yloxy-5-(trifluoromethyl)aniline;hydrochloride
Also Known As: 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride, 2-Isopropoxy-5-(trifluoromethyl)-aniline hydrochloride, 2-Isopropoxy-5-trifluoromethyl-phenylamine, VU0494100-1, [2-isopropoxy-5-(trifluoromethyl)phenyl]amine hydrochloride
| Molecular Formula | C10H13ClF3NO |
|---|---|
| Molecular Weight | 255.06 g/mol |
| LogP | 3.4966 |
| Topological Polar Surface Area | 35.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.06378 |
| Heavy Atoms | 16 |
| Complexity | 352.40765 |
Chemical Identifiers
| CAS Number | 473574-83-3 |
|---|---|
| SMILES | CC(C)OC1=C(C=C(C=C1)C(F)(F)F)N.Cl |
Product Overview
2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride (CAS 473574-83-3), with molecular formula C10H13ClF3NO and molecular weight 255.06 g/mol. IUPAC: 2-propan-2-yloxy-5-(trifluoromethyl)aniline;hydrochloride.
Chemical Property Profile of 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride
Property Insights of 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride
The XLogP value of 3.4966 indicates that 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.25 Ų, 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride 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-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride?
The CAS number of 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride is 473574-83-3.
What is the molecular formula of 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride?
The molecular formula of 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride is C10H13ClF3NO.
What is the molecular weight of 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride?
The molecular weight of 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride is 255.06 g/mol.
Where can I buy 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride?
You can request a quote for 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Isopropoxy-5-(trifluoromethyl)aniline hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.