Key Documents

View All Documentation

472190

2-Fluoro-5-(trifluoromethyl)phenyl isocyanate

Name: 2-Fluoro-5-(trifluoromethyl)phenyl isocyanate
Brand: ALDRICH

97%

Select a Size

Change View

About This Item

Linear Formula:

FC₆H₃(CF₃)NCO

CAS Number:

69922-27-6

Molecular Weight:

205.11

NACRES:

NA.22

PubChem Substance ID:

24870787

UNSPSC Code:

12352100

MDL number:

MFCD00673069

Assay:

97%

Technical Service

Need help? Our team of experienced scientists is here for you.

Let Us Assist

Properties

Quality Level

100

assay

97%

refractive index

n20/D 1.455 (lit.)

bp

53 °C/2.5 mmHg (lit.)

density

1.418 g/mL at 25 °C (lit.)

functional group

fluoro, isocyanate

SMILES string

Fc1ccc(cc1N=C=O)C(F)(F)F

InChI

1S/C8H3F4NO/c9-6-2-1-5(8(10,11)12)3-7(6)13-4-14/h1-3H

InChI key

NAIKHCBDZGSGHH-UHFFFAOYSA-N

Description

General description

2-Fluoro-5-(trifluoromethyl)phenyl isocyanate is a fluorinated building block.

Application

Useful pharmaceutical building block for the preparation of ureas from amines.

pictograms

GHS08,GHS07

signalword

Danger

hcodes

H302 + H312 + H332,H315,H317,H319,H334,H335

pcodes

P261 - P264 - P280 - P301 + P312 - P302 + P352 + P312 - P305 + P351 + P338

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

159.8 °F - closed cup

flash_point_c

71 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Choose from one of the most recent versions:

Certificates of Analysis (COA)

Lot/Batch Number

Don't see the Right Version?

If you require a particular version, you can look up a specific certificate by the Lot or Batch number.

Search for a COA

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

Isothiazolopyrimidines and isoxazolopyrimidines as novel multi-targeted inhibitors of receptor tyrosine kinases.

Zhiqin Ji et al.

Bioorganic & medicinal chemistry letters, 16(16), 4326-4330 (2006-06-01)

A series of isothiazolopyrimidines and isoxazolopyrimidines were synthesized and identified as potent KDR inhibitors. SAR studies led to isothiazolopyrimidine urea analogs that potently inhibit VEGFR tyrosine kinases (KDR enzymatic and cellular IC(50) values below 10 nM) as well as cKIT

Global Trade Item Number

SKU	GTIN
472190-500MG	04061836827052
472190-2G	04061836820688