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About This Item
Empirical Formula (Hill Notation):
C6H6N2O
CAS Number:
Molecular Weight:
122.12
Beilstein/REAXYS Number:
109630
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level
assay
97%
form
solid
mp
76-78 °C (lit.)
functional group
ketone
SMILES string
CC(=O)c1cnccn1
InChI
1S/C6H6N2O/c1-5(9)6-4-7-2-3-8-6/h2-4H,1H3
InChI key
DBZAKQWXICEWNW-UHFFFAOYSA-N
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Related Categories
Application
Acetylpyrazine has been used in synthesis of:
- 7-heteroaryl-pyrazolo[1,5-a]pyrimidine-3-carboxamides
- copper (II) complexes with di-imine ligands
- N(4) substituted thiosemicarbazones
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk_germany
WGK 2
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
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