4-(Trifluoromethyl)benzenemethanol
TL;DR: 4-(Trifluoromethyl)benzenemethanol (CAS 349-95-1) is a chemical compound with molecular formula C8H7F3O and molecular weight 176.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(trifluoromethyl)phenyl]methanol
Also Known As: 4-(Trifluoromethyl)benzyl alcohol, [4-(Trifluoromethyl)phenyl]methanol, (4-(trifluoromethyl)phenyl)methanol, p-Trifluoromethylbenzyl alcohol, dl-Mandelamide
| Molecular Formula | C8H7F3O |
|---|---|
| Molecular Weight | 176.04 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.0449 |
| Heavy Atoms | 12 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 349-95-1 |
|---|---|
| SMILES | C1=CC(=CC=C1CO)C(F)(F)F |
| InChIKey | MOOUWXDQAUXZRG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(Trifluoromethyl)benzenemethanol (CAS 349-95-1), with molecular formula C8H7F3O and molecular weight 176.04 g/mol. IUPAC: [4-(trifluoromethyl)phenyl]methanol.
Chemical Property Profile of 4-(Trifluoromethyl)benzenemethanol
Property Insights of 4-(Trifluoromethyl)benzenemethanol
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Trifluoromethyl)benzenemethanol. With a topological polar surface area (TPSA) of 20.2 Ų, 4-(Trifluoromethyl)benzenemethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Trifluoromethyl)benzenemethanol 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 4-(Trifluoromethyl)benzenemethanol?
The CAS number of 4-(Trifluoromethyl)benzenemethanol is 349-95-1.
What is the molecular formula of 4-(Trifluoromethyl)benzenemethanol?
The molecular formula of 4-(Trifluoromethyl)benzenemethanol is C8H7F3O.
What is the molecular weight of 4-(Trifluoromethyl)benzenemethanol?
The molecular weight of 4-(Trifluoromethyl)benzenemethanol is 176.04 g/mol.
Where can I buy 4-(Trifluoromethyl)benzenemethanol?
You can request a quote for 4-(Trifluoromethyl)benzenemethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Trifluoromethyl)benzenemethanol?
Yes, KEHONG BIO provides custom synthesis services for 4-(Trifluoromethyl)benzenemethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.