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238759

2-Nitro-4-(trifluoromethyl)phenol

Name: 2-Nitro-4-(trifluoromethyl)phenol
Brand: ALDRICH

99%

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About This Item

Linear Formula:

O₂NC₆H₃(CF₃)OH

CAS Number:

400-99-7

Molecular Weight:

207.11

NACRES:

NA.22

PubChem Substance ID:

24854345

UNSPSC Code:

12352100

EC Number:

206-927-9

MDL number:

MFCD00009791

Assay:

99%

Form:

liquid

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Properties

assay

99%

form

liquid

refractive index

n20/D 1.504 (lit.)

bp

92-94 °C/12 mmHg (lit.)

density

1.473 g/mL at 25 °C (lit.)

functional group

fluoro, nitro

SMILES string

Oc1ccc(cc1[N+]([O-])=O)C(F)(F)F

InChI

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

InChI key

XZEDEVRSUANQEM-UHFFFAOYSA-N

Description

General description

2-Nitro-4-(trifluoromethyl)phenol is the major product of solution phase photodecomposition of fluorodifen.

Application

2-Nitro-4-(trifluoromethyl)phenol has been used in the synthesis of 2-methyl-2-[2-nitro-4-(trifluoromethyl)phenoxy]propionic acid ethyl ester.

pictograms

GHS07

signalword

Warning

hcodes

H315,H319,H335

pcodes

P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

203.0 °F - closed cup

flash_point_c

95 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

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Unexpected smiles rearrangement during borane reduction of 2-aryloxy-2-methylpropionamides.

Buchstaller H-P and Anlauf U.

Synthesis, 2005(4), 639-643 (2005)

The aqueous photolysis of TFM and related trifluoromethylphenols. An alternate source of trifluoroacetic acid in the environment.

Ellis DA and Mabury SA.

Environmental Science & Technology, 34(4), 632-637 (2000)

Global Trade Item Number

SKU	GTIN
309664-1G	04061826062821
238759-1G	04061838787149