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About This Item
Empirical Formula (Hill Notation):
C6H3ClN2
CAS Number:
Molecular Weight:
138.55
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
InChI
1S/C6H3ClN2/c7-5-1-2-9-6(3-5)4-8/h1-3H
SMILES string
Clc1ccnc(c1)C#N
InChI key
DYEZRXLVZMZHQT-UHFFFAOYSA-N
assay
97%
form
solid
mp
81-85 °C
Application
Substrate used to prepare chiral dialkylaminopyridines bearing a C-2 hydroxyalkyl group via biocatalysis.
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 3 Oral - Eye Dam. 1
Storage Class
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Faceshields, Gloves
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Tetrahedron Asymmetry, 17, 1007-1007 (2006)
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