3-(Trifluoromethyl)benzylamine
TL;DR: 3-(Trifluoromethyl)benzylamine (CAS 2740-83-2) is a chemical compound with molecular formula C8H8F3N and molecular weight 175.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(trifluoromethyl)phenyl]methanamine
Also Known As: 3-(Trifluoromethyl)benzylamine, (3-(Trifluoromethyl)phenyl)methanamine, [3-(Trifluoromethyl)phenyl]methanamine, Benzylamine der, z1r cxfff
| Molecular Formula | C8H8F3N |
|---|---|
| Molecular Weight | 175.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 175.06088 |
| Heavy Atoms | 12 |
| Complexity | 144.0 |
Chemical Identifiers
| CAS Number | 2740-83-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)CN |
| InChIKey | YKNZTUQUXUXTLE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Trifluoromethyl)benzylamine (CAS 2740-83-2), with molecular formula C8H8F3N and molecular weight 175.06 g/mol. IUPAC: [3-(trifluoromethyl)phenyl]methanamine.
Chemical Property Profile of 3-(Trifluoromethyl)benzylamine
Property Insights of 3-(Trifluoromethyl)benzylamine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Trifluoromethyl)benzylamine. With a topological polar surface area (TPSA) of 26.0 Ų, 3-(Trifluoromethyl)benzylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Trifluoromethyl)benzylamine has 1 hydrogen bond donor(s) and 4 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 3-(Trifluoromethyl)benzylamine?
The CAS number of 3-(Trifluoromethyl)benzylamine is 2740-83-2.
What is the molecular formula of 3-(Trifluoromethyl)benzylamine?
The molecular formula of 3-(Trifluoromethyl)benzylamine is C8H8F3N.
What is the molecular weight of 3-(Trifluoromethyl)benzylamine?
The molecular weight of 3-(Trifluoromethyl)benzylamine is 175.06 g/mol.
Where can I buy 3-(Trifluoromethyl)benzylamine?
You can request a quote for 3-(Trifluoromethyl)benzylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Trifluoromethyl)benzylamine?
Yes, KEHONG BIO provides custom synthesis services for 3-(Trifluoromethyl)benzylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.