![3-[4-(三氟甲基)苯基]丙烯酸 structure](/static/products/1664/16642-92-5.webp)
3-[4-(三氟甲基)苯基]丙烯酸
TL;DR: 3-[4-(三氟甲基)苯基]丙烯酸 (CAS 16642-92-5) is a chemical compound with molecular formula C10H7F3O2 and molecular weight 216.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(三氟甲基)苯基]丙烯酸
3-[4-(trifluoromethyl)phenyl]prop-2-enoic acid
Also Known As: 4-(Trifluoromethyl)cinnamic acid, 4-Trifluoromethylcinnamic acid, trans-4-(Trifluoromethyl)cinnamic acid, Trifluperidol hydrochloride, Intermediates-ZCF02250
| Molecular Formula | C10H7F3O2 |
|---|---|
| Molecular Weight | 216.04 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.03981 |
| Heavy Atoms | 15 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 16642-92-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C=CC(=O)O)C(F)(F)F |
| InChIKey | ANRMAUMHJREENI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-[4-(三氟甲基)苯基]丙烯酸 (CAS 16642-92-5), with molecular formula C10H7F3O2 and molecular weight 216.04 g/mol. IUPAC: 3-[4-(trifluoromethyl)phenyl]prop-2-enoic acid.
Chemical Property Profile of 3-[4-(三氟甲基)苯基]丙烯酸
Property Insights of 3-[4-(三氟甲基)苯基]丙烯酸
The XLogP value of 3.0 indicates that 3-[4-(三氟甲基)苯基]丙烯酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3-[4-(三氟甲基)苯基]丙烯酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[4-(三氟甲基)苯基]丙烯酸 has 1 hydrogen bond donor(s) and 5 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-[4-(三氟甲基)苯基]丙烯酸?
The CAS number of 3-[4-(三氟甲基)苯基]丙烯酸 is 16642-92-5.
What is the molecular formula of 3-[4-(三氟甲基)苯基]丙烯酸?
The molecular formula of 3-[4-(三氟甲基)苯基]丙烯酸 is C10H7F3O2.
What is the molecular weight of 3-[4-(三氟甲基)苯基]丙烯酸?
The molecular weight of 3-[4-(三氟甲基)苯基]丙烯酸 is 216.04 g/mol.
Where can I buy 3-[4-(三氟甲基)苯基]丙烯酸?
You can request a quote for 3-[4-(三氟甲基)苯基]丙烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(三氟甲基)苯基]丙烯酸?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(三氟甲基)苯基]丙烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.