88-30-2

Basic information

• Product Name: 4-NITRO-3-(TRIFLUOROMETHYL)PHENOL
• Synonyms: 4-nitro-alpha,alpha,alpha-trifluoro-m-creso;alpha,alpha,alpha-trifluoro-4-nitro-m-creso;alpha,alpha,alpha-Trifluoro-4-nitro-m-cresol;Dowlap F;dowlapf;Lamprecid;m-Cresol, 4-nitro-alpha,alpha,alpha-trifluoro-;m-Cresol, alpha,alpha,alpha-trifluoro-4-nitro-
• CAS NO: 88-30-2
• Molecular Formula: C₇H₄F₃NO₃
• Molecular Weight: 207.11
• EINECS: 201-818-2
• Product Categories: Aromatic Halides (substituted);Organics;Phenol&Thiophenol&Mercaptan;C6 to C8;Bioactive Small Molecules;Building Blocks;Cell Biology;Chemical Synthesis;N;Organic Building Blocks;Oxygen Compounds;Phenols
• Mol File: 88-30-2.mol
• Article Data: 5

Chemical Properties

• Melting Point: 76-79 °C(lit.)
• Boiling Point: 135-138 °C0.01 mm Hg(lit.)
• Flash Point: 135-138°C/0.01mm
• Appearance: Yellow/Crystalline Powder
• Density: 1.554
• Vapor Pressure: 0.000398mmHg at 25°C
• Refractive Index: 1.507
• Solubility: soluble in Methanol
• PKA: 6.07(at 25℃)
• Water Solubility: 15.05g/L at 20℃
• Merck: 14,9253
• BRN: 2053698
• CAS DataBase Reference: 4-NITRO-3-(TRIFLUOROMETHYL)PHENOL(CAS DataBase Reference)
• NIST Chemistry Reference: 4-NITRO-3-(TRIFLUOROMETHYL)PHENOL(88-30-2)
• EPA Substance Registry System: 4-NITRO-3-(TRIFLUOROMETHYL)PHENOL(88-30-2)

Safety Data

• Hazard Codes: Xn,Xi
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-28-36/37/39-45
• RIDADR: 2588
• WGK Germany: 3
• RTECS: GP3520000
• HazardClass: 6.1(b)
• PackingGroup: III
• Hazardous Substances Data: 88-30-2(Hazardous Substances Data)

Usage

Chemical Properties

yellow crystalline powder

Uses

Different sources of media describe the Uses of 88-30-2 differently. You can refer to the following data:
1. Lamprey killer.
2. 4-Nitro-3-(trifluoromethyl)phenol is used in preparation of Bicyclic Heteroaryl substituted compounds as PAR4 inhibitors.

Flammability and Explosibility

Notclassified

Purification Methods

Crystallise the nitrophenol from *benzene or from pet ether/*benzene mixture. [Beilstein 6 III 1328.]

InChI:InChI=1/C7H4F3NO3/c8-7(9,10)5-3-4(12)1-2-6(5)11(13)14/h1-3,12H

Upstream product

• 351-36-0 N-acetyl-3-trifluoromethylbenzenamine 
• 393-11-3 4-nitro-3-(trifluoromethyl)benzeneamine 
• 384-22-5 2-nitrobenzotrifluoride 
• 98-17-9 3-Trifluoromethylphenol 
• 118-83-2 5-chloro-2-nitrotrifluoromethylbenzene 

Downstream Products

• 445-04-5 4-amino-3-(trifluoromethyl)-phenol 
• 19125-94-1 Bis<4-nitro-3-trifluormethyl-phenyl>-oxalat 
• 21315-03-7 4-cyclopropylmethoxy-1-nitro-2-trifluoromethylbenzene 
• 62100-47-4 2-Methyl-2-(4-nitro-3-trifluoromethyl-phenoxy)-propionic acid 
• 344-39-8 4-methoxy-1-nitro-2-(trifluoromethyl)benzene 
• 1027422-94-1 2-(3-{2-[3-(4-nitro-3-trifluoromethyl-phenoxy)-prop-1-ynyl]-phenyl}-prop-2-ynyloxy)-tetrahydro-pyran 
• 1018895-10-7 tert-butyl 4-(3-(4-nitro-3-(trifluoromethyl)phenoxy)propyl)piperazine-1-carboxylate 
• 53903-49-4 4-methoxy-2-(trifluoromethyl)benzenamine 

Relevant articles and documents

Selective Light-Driven Chemoenzymatic Trifluoromethylation/Hydroxylation of Substituted Arenes

The merging of photoredox trifluoromethylation with hybrid P450 BM3 variants has enabled the selective light-driven functionalization of several arenes. This approach capitalizes on the unique photochemical properties of the Ru(II)-diimine photosensitizer

A practical approach for regioselective mono-nitration of phenols under mild conditions

Cu(NO3)2.3H2O was demonstrated to be an efficient, regioselective and inexpensive nitrating reagent for the synthesis of mono-nitro substituted phenolic compounds. 12 examples of different phenols were examined. Good yields (67-90%) have been achieved. ARKAT-USA, Inc.

Hydroxylation of Nitroarenes with Alkyl Hydroperoxide Anions via Vicarious Nucleophilic Substitution of Hydrogen

Rhone-Poulenc Polska Ltd., ul. Grzybowska 80/82, 00-844 Warszawa, Poland Garbo- and heterocyclic nitroarenes react with anions of tert-butyl and cumyl hydroperoxides in the presence of strong bases to form substituted o- and p-nitrophenols. The reaction usually proceeds in high yields and is of practical value as a method of synthesis and manufacturing of nitrophenols. Orientation of the hydroxylation can be controlled to a substantial extent by selection of the proper conditions. Basic mechanistic features of this process were clarified.