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About This Item
Empirical Formula (Hill Notation):
C18D5H13ClN3O
CAS Number:
Molecular Weight:
332.84
NACRES:
NA.24
PubChem Substance ID:
UNSPSC Code:
12352005
MDL number:
Isotopic purity:
≥97 atom % D
Assay:
≥98% (CP)
Mass shift:
M+5
Form:
powder
isotopic purity
≥97 atom % D
Quality Segment
assay
≥98% (CP)
form
powder
technique(s)
mass spectrometry (MS): suitable
mass shift
M+5
storage temp.
−20°C
SMILES string
[2H]C([2H])([2H])C([2H])([2H])NCc1cc(Nc2ccnc3cc(Cl)ccc23)ccc1O
InChI
1S/C18H18ClN3O/c1-2-20-11-12-9-14(4-6-18(12)23)22-16-7-8-21-17-10-13(19)3-5-15(16)17/h3-10,20,23H,2,11H2,1H3,(H,21,22)/i1D3,2D2
InChI key
VRXFDHAGFYWGHT-ZBJDZAJPSA-N
Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 3 Oral - Aquatic Chronic 4 - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
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
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