1,4-Naphthalenedicarbonitrile
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1,4-Naphthalenedicarbonitrile
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CAS No:
3029-30-9
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Formula:
C12H6N2
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Chemical Name:
1,4-Naphthalenedicarbonitrile
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Synonyms:
1,4-Naphthalenedicarbonitrile;1,4-Dicyanonaphthalene;NSC 128542
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CAS No:
Description
1,4-Dicyanonaphthalene is used in biological studies as electron transfer mechanism of nucleic acid precursors and ctDNA with protein enzymes and several fluorescence probes in both static and excited states.
1,4-Naphthalenedicarbonitrile Basic Attributes
178.18900
178.19
221-197-1
128542
DTXSID00184374
2926909090
Characteristics
47.58000
2.58316
1.23g/cm3
206 °C @ Solvent: Acetic acid
401.2ºC at 760mmHg
205ºC
1.663
Safety Information
III
6.1
UN 3276
20/21/22-36/37/38
S22-S24/25
P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, P501
H301
UN 3276
|Danger|H301 (20%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 8 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:178.19
XLogP3:2.8
Hydrogen Bond Acceptor Count:2
Exact Mass:178.053098200
Monoisotopic Mass:178.053098200
Topological Polar Surface Area:47.6
Heavy Atom Count:14
Complexity:271
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes