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About This Item
Linear Formula:
C6D5ND2
CAS Number:
Molecular Weight:
100.17
NACRES:
NA.12
PubChem Substance ID:
UNSPSC Code:
12352116
EC Number:
238-580-4
MDL number:
Isotopic purity:
98 atom % D
Assay:
99% (CP)
Mass shift:
M+7
isotopic purity
98 atom % D
Quality Segment
assay
99% (CP)
refractive index
n
bp
184 °C (lit.)
mp
-6 °C (lit.)
density
1.098 g/mL at 25 °C
mass shift
M+7
storage temp.
2-8°C
SMILES string
[2H]N([2H])c1c([2H])c([2H])c([2H])c([2H])c1[2H]
InChI
1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2/i1D,2D,3D,4D,5D/hD2
InChI key
PAYRUJLWNCNPSJ-LQHBDRBESA-N
signalword
Danger
Hazard Classifications
Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Aquatic Acute 1 - Aquatic Chronic 1 - Carc. 2 - Eye Dam. 1 - Muta. 2 - Skin Sens. 1 - STOT RE 1
Storage Class
6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
flash_point_f
158.0 °F - closed cup
flash_point_c
70 °C - closed cup
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