Cyclohexanamine, N-hydroxy-, hydrochloride (1:1)
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Cyclohexanamine, N-hydroxy-, hydrochloride (1:1)
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CAS No:
25100-12-3
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Formula:
C6H13NO.ClH
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Chemical Name:
Cyclohexanamine, N-hydroxy-, hydrochloride (1:1)
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Synonyms:
Cyclohexanamine,N-hydroxy-,hydrochloride (1:1);Hydroxylamine,N-cyclohexyl-,hydrochloride;Cyclohexanamine,N-hydroxy-,hydrochloride;N-Cyclohexylhydroxylamine hydrochloride;Cyclohexylhydroxylammonium chloride;Cyclohexylhydroxyamine hydrochloride;N-Hydroxycyclohexanamine hydrochloride;Cyclohexylhydroxylamine hydrochloride;72762-44-8
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CAS No:
Cyclohexanamine, N-hydroxy-, hydrochloride (1:1) Basic Attributes
151.63
151.07600
3672798
246-612-3
R98VSP3T5L
DTXSID80179788
Safety Information
NONH for all modes of transport
3
36/37/38-41-37/38-22
26-36-39
Xi,Xn
P261-P280-P305 + P351 + P338
H302-H315-H318-H335
|Danger|H302 (90.48%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 42 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Cyclohexanamine, N-hydroxy-, hydrochloride (1:1) Use and Manufacturing
General procedure: In a microwave vial the aldehyde derivative (15-23, 1 mmol), hydroxylaminehydrochloride (N-tert-butyl, N-benzyl or N-cyclohexyl, 1.5 mmol) and NaHCO3 (1.5 mmol) were added in 3-5mL oftetrahydrofuran at 90 C for 10 min with 10 s of pre-stirring.Dichloromethane (20 mL) was added and extracted with water(2 x 10 mL). The organic phases were combined, the solvent wasevaporated and the compound purified by silica gel flash chromatographyusing ethyl acetate:methanol (9:1) as eluting system. Thecontrol reaction was performed by TLC (silica gel, ethyl acetate).General procedure: In a microwave vial the aldehyde derivative (15-23, 1 mmol), hydroxylaminehydrochloride (N-tert-butyl, N-benzyl or N-cyclohexyl, 1.5 mmol) and NaHCO3 (1.5 mmol) were added in 3-5mL oftetrahydrofuran at 90 C for 10 min with 10 s of pre-stirring.Dichloromethane (20 mL) was added and extracted with water(2 x 10 mL). The organic phases were combined, the solvent wasevaporated and the compound purified by silica gel flash chromatographyusing ethyl acetate:methanol (9:1) as eluting system. Thecontrol reaction was performed by TLC (silica gel, ethyl acetate).General procedure: In a microwave vial the aldehyde derivative (15-23, 1 mmol), hydroxylaminehydrochloride (N-tert-butyl, N-benzyl or N-cyclohexyl, 1.5 mmol) and NaHCO3 (1.5 mmol) were added in 3-5mL oftetrahydrofuran at 90 C for 10 min with 10 s of pre-stirring.Dichloromethane (20 mL) was added and extracted with water(2 x 10 mL). The organic phases were combined, the solvent wasevaporated and the compound purified by silica gel flash chromatographyusing ethyl acetate:methanol (9:1) as eluting system. Thecontrol reaction was performed by TLC (silica gel, ethyl acetate).General procedure: In a microwave vial the aldehyde derivative (15-23, 1 mmol), hydroxylaminehydrochloride (N-tert-butyl, N-benzyl or N-cyclohexyl, 1.5 mmol) and NaHCO3 (1.5 mmol) were added in 3-5mL oftetrahydrofuran at 90 C for 10 min with 10 s of pre-stirring.Dichloromethane (20 mL) was added and extracted with water(2 x 10 mL). The organic phases were combined, the solvent wasevaporated and the compound purified by silica gel flash chromatographyusing ethyl acetate:methanol (9:1) as eluting system. Thecontrol reaction was performed by TLC (silica gel, ethyl acetate).General procedure: In a microwave vial the aldehyde derivative (15-23, 1 mmol), hydroxylaminehydrochloride (N-tert-butyl, N-benzyl or N-cyclohexyl, 1.5 mmol) and NaHCO3 (1.5 mmol) were added in 3-5mL oftetrahydrofuran at 90 C for 10 min with 10 s of pre-stirring.Dichloromethane (20 mL) was added and extracted with water(2 x 10 mL). The organic phases were combined, the solvent wasevaporated and the compound purified by silica gel flash chromatographyusing ethyl acetate:methanol (9:1) as eluting system. Thecontrol reaction was performed by TLC (silica gel, ethyl acetate).
Computed Properties
Molecular Weight:151.63
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:151.0763918
Monoisotopic Mass:151.0763918
Topological Polar Surface Area:32.3
Heavy Atom Count:9
Complexity:59.5
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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