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About This Item
Empirical Formula (Hill Notation):
C6H6ClN · HCl
CAS Number:
Molecular Weight:
164.03
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
230-149-9
Beilstein/REAXYS Number:
3689155
MDL number:
Assay:
98%
Form:
solid
Quality Segment
assay
98%
form
solid
mp
120-124 °C (lit.)
functional group
chloro
SMILES string
Cl[H].ClCc1ccccn1
InChI
1S/C6H6ClN.ClH/c7-5-6-3-1-2-4-8-6;/h1-4H,5H2;1H
InChI key
JPMRGPPMXHGKRO-UHFFFAOYSA-N
Application
2-(Chloromethyl)pyridine hydrochloride was used as reagent in base catalyzed alkylation of p-tert-butylcalix[6]arene and p-tert-butylcalix[5]arene in DMF. It was used in the synthesis of Gd3+ diethylenetriaminepentaacetic acid bisamide complex, a Zn2+-sensitive magnetic resonance imaging contrast agent.
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Skin Corr. 1B
Storage Class
8A - Combustible corrosive hazardous materials
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
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