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About This Item
Empirical Formula (Hill Notation):
C16H12N4OS
CAS Number:
Molecular Weight:
308.36
NACRES:
NA.32
PubChem Substance ID:
UNSPSC Code:
12352200
Beilstein/REAXYS Number:
23580408
Quality Segment
assay
≥95.0% (HPLC)
fluorescence
λex 355 nm; λem 449 nm±10 nm in DMSO
storage temp.
−20°C
SMILES string
COC1=CC=C2C(SC(/C=C/C3=CC=C(N=[N+]=[N-])C=C3)=N2)=C1
InChI
1S/C16H12N4OS/c1-21-13-7-8-14-15(10-13)22-16(18-14)9-4-11-2-5-12(6-3-11)19-20-17/h2-10H,1H3/b9-4+
InChI key
ZOEXSFZBSQSYDV-RUDMXATFSA-N
flash_point_f
Not applicable
signalword
Warning
hcodes
Hazard Classifications
Aquatic Chronic 4 - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
13 - Non Combustible Solids
wgk
WGK 3
flash_point_c
Not applicable
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