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456861

4-Chlorophenoxyacetonitrile

Name: 4-Chlorophenoxyacetonitrile
Brand: ALDRICH

98%

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About This Item

Linear Formula:

ClC₆H₄OCH₂CN

CAS Number:

3598-13-8

Molecular Weight:

167.59

NACRES:

NA.22

PubChem Substance ID:

24869251

UNSPSC Code:

12352100

MDL number:

MFCD00031535

Assay:

98%

Form:

solid

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Properties

Quality Level

100

assay

98%

form

solid

mp

45-49 °C (lit.)

functional group

chloro, nitrile

SMILES string

Clc1ccc(OCC#N)cc1

InChI

1S/C8H6ClNO/c9-7-1-3-8(4-2-7)11-6-5-10/h1-4H,6H2

InChI key

YUGDKEWUYZXXRU-UHFFFAOYSA-N

Description

pictograms

GHS07

signalword

Warning

hcodes

H302 + H312 + H332

pcodes

P261 - P264 - P280 - P301 + P312 - P302 + P352 + P312 - P304 + P340 + P312

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

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Synthesis of C3-Substituted 4-Azaindoles: An Easy Access to 4-Azamelatonin and Protected 4-Azatryptophan.

Jeanty M, et al.

The Journal of Organic Chemistry, 73(!8), 7390-7393 (2008)

Novel and selective 5-HT2C/2B receptor antagonists as potential anxiolytic agents: synthesis, quantitative structure-activity relationships, and molecular modeling of substituted 1-(3-pyridylcarbamoyl) indolines.

Bromidge SM, et al.

Journal of Medicinal Chemistry, 41(10), 1598-1612 (1998)

Vlachou M, et al.

Heterocycles, 129-132 (2002)

Global Trade Item Number

SKU	GTIN
456861-25G	04061832100166
456861-5G	04061832100173