N-Boc-1,2-Diaminocyclohexane
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N-Boc-1,2-Diaminocyclohexane
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CAS No:
317595-54-3
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Formula:
C11H22N2O2
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Chemical Name:
N-Boc-1,2-Diaminocyclohexane
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Synonyms:
1-AMINO-2-(BOC-AMINO)CYCLOHEXANE;1-N-BOC-AMINO-1,2-CYCLOHEXANEDIAMINE;Carbamic acid, (2-aminocyclohexyl)-, 1,1-dimethylethyl ester (9CI);1-N-Boc-Amino-1,2-cyclohexaned;1-N-Boc-1,2-Cyclohexyldiamino;N-BOC-1,2-DIAMINOCYCLOHEXANE;Carbamic acid, N-(2-aminocyclohexyl)-, 1,1-dimethylethyl ester;N-Boc-trans-1
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CAS No:
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
N-Boc-1,2-Diaminocyclohexane Use and Manufacturing
General procedure: The 800 mL of methanol containing 16.53 g (0.453 mol) ofdry HCl was added dropwise to the solution of 51.78 g (0.453mol) of trans-(1R, 2R)-()-1, 2-diaminocyclohexane in 80 mLof methanol for 2 h. After adding 50 mL of water, 98.97 g(0.453 mol) of di-t-butyl dicarbonate was added by portions for1 h. The mixture was stirred for 2 h, and then methanol wasremoved. The residue was rinsed with 900 mL of ether and theinsoluble matter was filtered off and dried. The crude productwas dissolved in 800 mL of water and then extracted with amixture of 500 mL of CH2Cl2 and 340 mL of 2 M NaOH. Theorganic layer was retained and treated with MgSO4 and the solvent evaporated. Recrystallization from 900 mL of ligroingave 67.87 g (70percent) of trans-(1R, 2R)-1-Boc-amino-2-aminocyclohexane.A solution of Boc
Computed Properties
Molecular Weight:214.30
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:214.168127949
Monoisotopic Mass:214.168127949
Topological Polar Surface Area:64.4
Heavy Atom Count:15
Complexity:223
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes