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Key Documents

456861

Sigma-Aldrich

4-Chlorophenoxyacetonitrile

98%

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About This Item

Linear Formula:
ClC6H4OCH2CN
CAS Number:
Molecular Weight:
167.59
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

98%

form

solid

mp

45-49 °C (lit.)

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

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

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

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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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)

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