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Merck
CN

478970

4-Phenoxyphenyl isocyanate

98%

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About This Item

Linear Formula:
C6H5OC6H4NCO
CAS Number:
59377-19-4
Molecular Weight:
211.22
UNSPSC Code:
12352100
PubChem Substance ID:
24871587
MDL number:
MFCD00013876

Key Documents

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Product Name

4-Phenoxyphenyl isocyanate, 98%

InChI

1S/C13H9NO2/c15-10-14-11-6-8-13(9-7-11)16-12-4-2-1-3-5-12/h1-9H

SMILES string

O=C=Nc1ccc(Oc2ccccc2)cc1

InChI key

PNBUGOFIKAHZRW-UHFFFAOYSA-N

assay

98%

refractive index

n20/D 1.595 (lit.)

bp

170 °C/3 mmHg (lit.)

density

1.169 g/mL at 25 °C (lit.)

storage temp.

2-8°C

Application

4-Phenoxyphenyl isocyanate may be used in the preparation of 1-(4-phenoxyphenyl)-3-(thiazol-2-yl)urea.

General description

4-Phenoxyphenyl isocyanate, also known as 1-isocyanato-4-phenoxybenzene, is an aryl isocyanate. Its enthalpy of vaporization at boiling point has been reported.

pictograms

Health hazardExclamation mark
GHS08,GHS07

signalword

Danger

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

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

ppe

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

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
13206DE
13022BO
06510CB
05811EU
01404LR

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Faizul Azam et al.
Medicinal chemistry (Shariqah (United Arab Emirates)), 8(6), 1057-1068 (2012-06-30)
Synthesis of 1-(substituted aryl)-3-(thiazol-2-yl)urea derivatives was undertaken as our efforts to discover novel antiparkinsonian agents with improved pharmacological profile in haloperidol-induced catalepsy and oxidative stress in mice. Furfuryl, 2- and/or 3-methoxy substituted phenyl derivatives emerged as potent agents. With exception
Yaws CL.
Thermophysical Properties of Chemicals and Hydrocarbons, 605-605 (2008)

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