3-Chloro-4-(trifluoromethoxy)phenylamine (CAS 64628-73-5)

3-Chloro-4-(trifluoromethoxy)phenylamine (CAS 64628-73-5) is a chemical compound registered under number CAS 64628-73-5, with the molecular formula C₇H₅ClF₃NO, and a molar mass of 211.57 g/mol.

The molecule contains 18 atoms connected by 18 chemical bonds. The full systematic IUPAC name of this compound is 3-chloro-4-(trifluoromethoxy)aniline. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 3.2 (positive value, a lipophilic compound), polar surface area PSA = 35.3 Ų, 1 donors and 5 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Wzór sumaryczny	C7H5ClF3NO
Masa molowa	211.57 g/mol
IUPAC	3-chloro-4-(trifluoromethoxy)aniline
SMILES	C1=CC(=C(C=C1N)Cl)OC(F)(F)F
InChIKey	ZPKUUNGPBSRPRM-UHFFFAOYSA-N
logP (XLogP3)	3.2
PSA	35.3 Ų
HBD / HBA	1 / 5
PubChem CID	CID 2773843 ↗

Sygnał: Niebezpieczeństwo

H302 — Działa szkodliwie po połknięciu

H315 — Działa drażniąco na skórę

H319 — Działa drażniąco na oczy

3-Chloro-4-(trifluoromethoxy)aniline · 64628-73-5 · RefChem:278278 · DTXCID60329769 · 641-207-1 · MFCD00190126 · 3-chloro-4-(trifluoromethoxy)phenylamine · Benzenamine, 3-chloro-4-(trifluoromethoxy)- · CS-W015038 · 3-chloro-4-trifluoromethoxy-phenylamine · AC-3733 · DS-1290 · PS-8001 · SB79175 · 3-Chloro-4-(trifluoromethoxy)phenylamine, AldrichCPR

• 📊 PubChem CID 2773843 — NIH
• 🔬 NIST WebBook — spektroskopia
• 🌐 Wikidata
• 💊 ChEMBL — bioaktywność

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