Pimelonitrile
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Pimelonitrile
structure -
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CAS No:
646-20-8
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Formula:
C7H10N2
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Chemical Name:
Pimelonitrile
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Synonyms:
Heptanedinitrile;Pimelonitrile;Pimelic acid dinitrile;1,5-Dicyanopentane;NSC 5392;1,7-Heptanedinitrile
- Categories:
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CAS No:
Characteristics
47.6
-0.06
0.95070 g/cm3 @ Temp: 15 °C
-31.4 °C
155 °C
112 °C
1.437
Store below +30°C.
Oral-Rat LDL0: 500 mg/kg; Oral-Mouse LD50: 126 mg/kg
Open flame is flammable; high heat decomposes toxic nitrogen oxide and cyanide gas
Safety Information
III
6.1(b)
UN 3276 6.1/PG 3
3
20/21/22
36/37-24/25
MI9020000
Xn
The warehouse is ventilated at low temperature and dry; stored separately from oxidants, acids and food additives
P280-P301 + P310
H301-H312-H332
|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P312, P304+P340, P312, P321, P322, P330, P363, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:122.17
XLogP3:0.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:122.084398327
Monoisotopic Mass:122.084398327
Topological Polar Surface Area:47.6
Heavy Atom Count:9
Complexity:125
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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