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About This Item
Empirical Formula (Hill Notation):
C7D7N
CAS Number:
Molecular Weight:
112.18
UNSPSC Code:
12352005
PubChem Substance ID:
MDL number:
Isotopic purity:
97 atom % D
Assay:
97% (CP)
Mass shift:
M+7
Form:
liquid
InChI
1S/C7H7N/c1-2-7-5-3-4-6-8-7/h2-6H,1H2/i1D2,2D,3D,4D,5D,6D
SMILES string
[2H]\C([2H])=C(/[2H])c1nc([2H])c([2H])c([2H])c1[2H]
InChI key
KGIGUEBEKRSTEW-QMUWOJKRSA-N
isotopic purity
97 atom % D
assay
97% (CP)
form
liquid
bp
79-82 °C/29 mmHg (lit.)
density
1.038 at 25 °C
mass shift
M+7
storage temp.
−20°C
Related Categories
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
Hazard Classifications
Acute Tox. 3 Dermal - Acute Tox. 4 Oral - Aquatic Chronic 2 - Eye Dam. 1 - Flam. Liq. 3 - Skin Corr. 1B - Skin Sens. 1
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
118.4 °F
flash_point_c
48 °C
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