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CAS No.: | 16649-50-6 |
---|---|
Name: | N-tert-butylhydroxylamine |
Article Data: | 43 |
Molecular Structure: | |
Formula: | C4H11NO |
Molecular Weight: | 89.1374 |
Synonyms: | Hydroxylamine,N-tert-butyl- (6CI,8CI);2-Hydroxylamino-2-methylpropane;N-Hydroxy-tert-butylamine;N-t-Butylhydroxylamine;N-tert-Butylhydroxylamine;NSC 150349;NSC 239719;tert-Butylhydroxylamine; |
EINECS: | 260-771-6 |
Density: | 0.883 g/cm3 |
Melting Point: | 64℃ |
Boiling Point: | 120.922 °C at 760 mmHg |
Flash Point: | 43.614 °C |
PSA: | 32.26000 |
LogP: | 1.15460 |
2-Methyl-2-nitropropane
N-tert-Butylhydroxylamine
Conditions | Yield |
---|---|
With acetic acid; zinc In ethanol at 10 - 20℃; for 3h; | 100% |
With ammonia borane; gold on titanium oxide In ethanol at 20℃; for 0.666667h; Inert atmosphere; | 85% |
Reduction; | 82% |
(Z)-1-(1,1-dimethylathyl)-2-phthalimido-diazen-1-oxid
N-tert-Butylhydroxylamine
Conditions | Yield |
---|---|
With hydrazine hydrate at 5℃; | 95% |
tert-butylamine
N-tert-Butylhydroxylamine
Conditions | Yield |
---|---|
With urea hydrogen peroxide adduct In diethyl ether at 20℃; for 1h; Catalytic behavior; Inert atmosphere; | 85% |
With urea hydrogen peroxide adduct; sodium tungstate In diethyl ether at 20℃; for 6h; | 80% |
4-hydroxy-3-ethoxybenzaldehyde
1-Iodohexane
A
α-(3-ethoxy-4-hexyloxyphenyl)-N-tert-butylnitrone
B
N-tert-Butylhydroxylamine
Conditions | Yield |
---|---|
With sodium hydroxide In ethanol; ethyl acetate | A 57.2% B n/a |
diethyl ether
ethyl nitrite
tert-butylmagnesium chloride
A
N-tert-Butylhydroxylamine
B
N,N-di-tert-butylhydroxylamine
C
N-nitroso-N-tert-butylhydroxylamine
Conditions | Yield |
---|---|
at -30℃; |
2-tert-butyl-3-methoxy-oxaziridine
N-tert-Butylhydroxylamine
Conditions | Yield |
---|---|
(i) TsOH, CH2Cl2, H2O, benzene, (ii) NaOH; Multistep reaction; |
tert-butylmagnesium chloride
N-tert-Butylhydroxylamine
Conditions | Yield |
---|---|
With nitrosylchloride In diethyl ether |
(Z)-N-benzylidene-2-methylpropan-2-amine oxide
A
N-tert-Butylhydroxylamine
B
benzaldehyde
Conditions | Yield |
---|---|
With water at 25℃; Rate constant; hydrolysis; |
Conditions | Yield |
---|---|
With hydrogenchloride In water at 25℃; Rate constant; in presence of NaCl, n-butylammonium chloride, didodecyldimethylammonium chloride (DdDMAC), dodecylammonium chloride (DdAC); effect of colloidal phase; | |
With dodecylammonium chloride In hydrogenchloride at 25℃; Rate constant; pH = 1; | |
With water; sodium hydroxide pH=10 - 12; Kinetics; Reagent/catalyst; pH-value; |
N-<(4-Methylphenyl)methylene>-2-methyl-2-propanamine N-oxide
A
N-tert-Butylhydroxylamine
B
4-methyl-benzaldehyde
Conditions | Yield |
---|---|
With water at 25℃; Rate constant; hydrolysis; |
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The N-tert-Butylhydroxylamine, with the CAS registry number 16649-50-6, is also known as 2-Hydroxylamino-2-methylpropane. This chemical's molecular formula is C4H11NO and molecular weight is 89.14. What's more, its systematic name is N-Hydroxy-2-methyl-2-propanamine.
Physical properties of N-tert-Butylhydroxylamine are: (1)ACD/LogP: 0.885; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.33; (4)ACD/LogD (pH 7.4): 0.81; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 2.31; (7)ACD/KOC (pH 5.5): 4.37; (8)ACD/KOC (pH 7.4): 60.28; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 32.26 Å2; (13)Index of Refraction: 1.423; (14)Molar Refractivity: 25.676 cm3; (15)Molar Volume: 100.933 cm3; (16)Polarizability: 10.179×10-24cm3; (17)Surface Tension: 27.5 dyne/cm; (18)Density: 0.883 g/cm3; (19)Flash Point: 43.614 °C; (20)Enthalpy of Vaporization: 41.841 kJ/mol; (21)Boiling Point: 120.922 °C at 760 mmHg; (22)Vapour Pressure: 7.2 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: ONC(C)(C)C
(2)Std. InChI: InChI=1S/C4H11NO/c1-4(2,3)5-6/h5-6H,1-3H3
(3)Std. InChIKey: XWESXZZECGOXDQ-UHFFFAOYSA-N