7-CYANO-1,2,3,4-TETRAHYDROISOQUINOLINE
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7-CYANO-1,2,3,4-TETRAHYDROISOQUINOLINE
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CAS No:
149355-52-2
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Formula:
C10H10N2
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Chemical Name:
7-CYANO-1,2,3,4-TETRAHYDROISOQUINOLINE
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Synonyms:
1,2,3,4-TETRAHYDRO-ISOQUINOLINE-7-CARBONITRILE;7-CYANO-1,2,3,4-TETRAHYDROISOQUINOLINE;7-Isoquinolinecarbonitrile, 1,2,3,4-tetrahydro-;1,2,3,4-Tetrahydro-isoquinolin-7-carbonitrile
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CAS No:
Safety Information
3439
20/21/22-51-22
22-36/37/39
Xn
P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P312, P321, P322, P330, P361, P363, P405, P501
H301
|Danger|H301 (33.33%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P312, P321, P322, P330, P361, P363, P405, and P501|Aggregated GHS information provided by 3 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
7-CYANO-1,2,3,4-TETRAHYDROISOQUINOLINE Use and Manufacturing
Hydrochloric acid (30.6 ml; 2 equiv.) was added at 0° C. to a solution of 1, 2, 3, 4, -tetrahydroisoquinoline-7-amine (15.3 g; 1 equiv.) in 40 ml of water, and the reaction mixture was stirred for 10 minutes at -5° C. Sodium nitrate solution (7.13 g of sodium nitrate in 35 ml of water) was added dropwise at 0° C. in the course of 30 minutes, and the resulting reaction mixture was stirred for 30 minutes at 0° C. Finally, urea (1.86 g; 0.3 equiv.) was added. A mixture of sodium hydroxide solution (10.3 g of NaOH in 70 ml of H
Computed Properties
Molecular Weight:158.20
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:158.084398327
Monoisotopic Mass:158.084398327
Topological Polar Surface Area:35.8
Heavy Atom Count:12
Complexity:203
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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7-CYANO-1,2,3,4-TETRAHYDROISOQUINOLINE
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