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Name |
4-Methylpentan-2-one oxime |
EINECS | 203-298-2 |
CAS No. | 105-44-2 | Density | 0.899 g/cm3 |
PSA | 32.59000 | LogP | 1.88260 |
Solubility | N/A | Melting Point |
63 °C |
Formula | C6H13NO | Boiling Point | 179.76 °C at 760 mmHg |
Molecular Weight | 115.175 | Flash Point | 88.096 °C |
Transport Information | N/A | Appearance | Colorless transparent liquid |
Safety | 26-36 | Risk Codes | 20/21/22-36 |
Molecular Structure | Hazard Symbols | Xn | |
Synonyms |
2-Methyl-4-pentanoneoxime;4-Methyl-2-pentanone oxime;Isobutyl methyl ketone oxime;Methylisobutyl ketone oxime; |
Article Data | 14 |
Conditions | Yield |
---|---|
With hydroxylamine hydrochloride; sodium hydroxide In water at 0℃; | 96% |
With hydroxylamine hydrochloride; sodium acetate In ethanol for 0.166667h; Condensation; Irradiation; | 92% |
With hydroxylamine hydrochloride; sodium hydroxide In ethanol; water at 60℃; for 3h; | 68% |
With hydroxylamine hydrochloride; sodium acetate In ethanol; water at 100℃; |
Conditions | Yield |
---|---|
Heating; | 82% |
Conditions | Yield |
---|---|
With acetylhydroxamic acid; sulfuric acid In acetonitrile for 11.5h; Reflux; | A 8% B 74% |
Conditions | Yield |
---|---|
With hydrogenchloride; nitrosylchloride at 20℃; for 9h; Irradiation; |
Conditions | Yield |
---|---|
With dihydrogen peroxide; tripropylammonium fluorochromate (VI) In acetone at 0 - 10℃; for 0.333333h; | 98% |
With KMnO4/alumina In diethyl ether at 0℃; for 1h; | 97% |
With potassium permanganate In water; acetonitrile at 25℃; for 1h; | 96% |
4-methyl-pentan-2-one oxime
2-nitro-4-methylpentane
Conditions | Yield |
---|---|
With dihydrogen peroxide; potassium hydroxide In tert-butyl alcohol at 72℃; under 2250.23 Torr; | 96.1% |
4-methyl-pentan-2-one oxime
N,N'-dichlorobis(2,4,6-trichlorodiphenyl)urea
A
2-chloro-4-methyl-2-nitroso-pentane
B
bis(2,4,6-trichlorodiphenyl)urea
Conditions | Yield |
---|---|
In acetonitrile at 20℃; for 0.333333h; | A 95% B n/a |
2,4,6-trinitrochlorobenzene
4-methyl-pentan-2-one oxime
4-Methyl-2-pentanonoxim-pikrat
Conditions | Yield |
---|---|
With pyridine In acetone at 0℃; for 5h; | 85% |
Conditions | Yield |
---|---|
With iron(III) chloride at 90℃; for 2h; Beckmann rearrangement of ketoximes; | 85% |
IUPAC: N-(4-methylpentan-2-ylidene)hydroxylamine
Methyl isobutyl ketoxime (CAS NO.105-44-2) is also called for 2-Methyl-4-pentanone oxime ; 4-01-00-03307 (Beilstein Handbook Reference) ; 4-Methyl-2-pentanone oxime ; BRN 1741644 ; EINECS 203-298-2 ; Methyl isobutyl oxime ; NSC 1070 ; USAF AM-4 ; 2-Pentanone, 4-methyl-, oxime ; 4-Methylpentan-2-one oxime and so on.
Molecular Formula: C6H13NO
Molecular Weight: 115.17
EINECS: 203-298-2
LogP: ACD/LogP: 1.53
XLogP: 1.80
ACD/LogD (pH 5.5): 1.53
ACD/LogD (pH 7.4): 1.53
ACD/BCF (pH 5.5): 8.57
ACD/BCF (pH 7.4): 8.57
ACD/KOC (pH 5.5): 161.95
ACD/KOC (pH 7.4): 161.94
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 3
Index of Refraction: 1.436
Molar Refractivity: 33.54 cm3
Molar Volume: 128.1 cm3
Surface Tension: 25.8 dyne/cm
Density: 0.89 g/cm3
Flash Point: 88.1 °C
Enthalpy of Vaporization: 45.87 kJ/mol
Boiling Point: 179.8°C at 760 mmHg
Vapour Pressure: 0.434 mmHg at 25°C
The molecular structure of Methyl isobutyl ketoxime (CAS NO.105-44-2):
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 200mg/kg (200mg/kg) | National Technical Information Service. Vol. AD277-689, | |
mouse | LD50 | oral | > 2gm/kg (2000mg/kg) | Medicina Experimentalis. Vol. 11, Pg. 137, 1964. |
Reported in EPA TSCA Inventory.
Poison by intraperitoneal route. Low toxicity by ingestion. When heated to decomposition it emits toxic fumes of NOx.
Hazard Codes: Xn
Risk Statements: 20/21/22-36
R20/21/22: Harmful by inhalation, in contact with skin and if swallowed
R36: Irritating to the eyes
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
S36: Wear suitable protective clothing
RTECS: SA9450000
Treatment of Methyl isobutyl ketoxime (CAS NO.105-44-2) in Wastewater, see as follows :
Total removal: 4.38 percent
Total biodegradation: 0.10 percent
Total sludge adsorption: 3.29 percent
Total to Air: 0.99 percent
(using 10000 hr Bio P,A,S)