CAS No.16649-50-6,N-tert-butylhydroxylamine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	16649-50-6
Name:	N-tert-butylhydroxylamine
Article Data:	43

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

Synthetic route

: 594-70-7
2-Methyl-2-nitropropane

: 16649-50-6
N-tert-Butylhydroxylamine

Conditions

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%

: 78661-66-2, 78661-76-4, 131229-52-2
(Z)-1-(1,1-dimethylathyl)-2-phthalimido-diazen-1-oxid

: 16649-50-6
N-tert-Butylhydroxylamine

Conditions

Conditions	Yield
With hydrazine hydrate at 5℃;	95%

: 75-64-9
tert-butylamine

: 16649-50-6
N-tert-Butylhydroxylamine

Conditions

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%

: 121-32-4
4-hydroxy-3-ethoxybenzaldehyde

: 638-45-9
1-Iodohexane

A: 223649-89-6
α-(3-ethoxy-4-hexyloxyphenyl)-N-tert-butylnitrone

B: 16649-50-6
N-tert-Butylhydroxylamine

Conditions

Conditions	Yield
With sodium hydroxide In ethanol; ethyl acetate	A 57.2% B n/a

...Expand

: 60-29-7
diethyl ether

: 109-95-5
ethyl nitrite

: 677-22-5
tert-butylmagnesium chloride

A: 16649-50-6
N-tert-Butylhydroxylamine

B: 10531-39-2
N,N-di-tert-butylhydroxylamine

C: 75005-93-5
N-nitroso-N-tert-butylhydroxylamine

Conditions

Conditions	Yield
at -30℃;

...Expand

: 49680-37-7, 103202-91-1, 103202-96-6
2-tert-butyl-3-methoxy-oxaziridine

: 16649-50-6
N-tert-Butylhydroxylamine

Conditions

Conditions	Yield
(i) TsOH, CH2Cl2, H2O, benzene, (ii) NaOH; Multistep reaction;

: 677-22-5
tert-butylmagnesium chloride

: 16649-50-6
N-tert-Butylhydroxylamine

Conditions

Conditions	Yield
With nitrosylchloride In diethyl ether

: 3376-24-7, 52392-70-8, 85225-53-2
(Z)-N-benzylidene-2-methylpropan-2-amine oxide

A: 16649-50-6
N-tert-Butylhydroxylamine

B: 100-52-7
benzaldehyde

Conditions

Conditions	Yield
With water at 25℃; Rate constant; hydrolysis;

: 3376-24-7
N-tert-butyl-α-phenylnitrone

A: 16649-50-6
N-tert-Butylhydroxylamine

B: 100-52-7
benzaldehyde

Conditions

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;

: 40117-29-1, 127895-99-2
N-<(4-Methylphenyl)methylene>-2-methyl-2-propanamine N-oxide

A: 16649-50-6
N-tert-Butylhydroxylamine

B: 104-87-0
4-methyl-benzaldehyde

Conditions

Conditions	Yield
With water at 25℃; Rate constant; hydrolysis;

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Specification

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