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About This Item
Empirical Formula (Hill Notation):
C13H11N3O
CAS Number:
Molecular Weight:
225.25
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352005
EC Number:
219-470-5
MDL number:
Assay:
97%
Quality Segment
assay
97%
reaction suitability
reaction type: C-C Bond Formation
mp
125.5-129.5 °C (lit.)
SMILES string
Cc1ccc(O)c(c1)-n2nc3ccccc3n2
InChI
1S/C13H11N3O/c1-9-6-7-13(17)12(8-9)16-14-10-4-2-3-5-11(10)15-16/h2-8,17H,1H3
InChI key
MCPKSFINULVDNX-UHFFFAOYSA-N
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signalword
Warning
hcodes
Hazard Classifications
Aquatic Chronic 1 - Skin Sens. 1B
Storage Class
11 - Combustible Solids
wgk
WGK 2
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
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