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439932

4-Acetylphenyl isocyanate

Name: 4-Acetylphenyl isocyanate
Brand: ALDRICH

97%

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About This Item

Linear Formula:

CH₃COC₆H₄NCO

CAS Number:

49647-20-3

Molecular Weight:

161.16

NACRES:

NA.22

PubChem Substance ID:

24867550

UNSPSC Code:

12352100

MDL number:

MFCD00013879

Assay:

97%

Form:

solid

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Properties

Quality Segment

100

assay

97%

form

solid

bp

139 °C/14 mmHg (lit.)

mp

35-37 °C (lit.)

functional group

isocyanate, ketone

SMILES string

CC(=O)c1ccc(cc1)N=C=O

InChI

1S/C9H7NO2/c1-7(12)8-2-4-9(5-3-8)10-6-11/h2-5H,1H3

InChI key

MOZSVHZOUDIZMF-UHFFFAOYSA-N

Description

General description

4-Acetylphenyl isocyanate is a reactive isocyanate and had one carbamate unit for every 7.6 graphene carbons.

Application

4-Acetylphenyl isocyanate may be used for the preparation of isocyanate-treated graphene oxide (iGO). It may be used for the following syntheses:

(4S,5R)-2-oxo-4-(4-phenyl-piperazin-1-ylmethyl)-oxazolidin-5-ylmethyl (4-acetyl-phenyl)-carbamate
(4S,5R)-2-oxo-4-(4-phenyl-piperazin-1-ylmethyl)-oxazolidin-5-ylmethyl (4-acetyl-phenyl)-carbamate
2-oxo-4-(4-phenyl-piperazin-1-ylmethyl)-oxazolidin-5-ylmethyl phenyl acetate
2-oxo-4-(4-phenyl-piperazin-1-ylmethyl)-oxazolidin-5-ylmethyl (4-acetyl-phenyl)-carbamate

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

11 - Combustible Solids

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

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