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CAS No.: | 598-53-8 |
---|---|
Name: | 2-Methoxypropane |
Article Data: | 32 |
Molecular Structure: | |
Formula: | C4H10O |
Molecular Weight: | 74.1228 |
Synonyms: | 2-Methoxypropane;2-Propylmethyl ether;Isopropyl methyl ether;Isopryl;Methyl iso-propyl ether;Methyl isopropylether;Ether,isopropyl methyl (6CI,7CI,8CI); |
EINECS: | 209-937-1 |
Density: | 0.731 g/cm3 |
Boiling Point: | 50.6 °C at 760 mmHg |
PSA: | 9.23000 |
LogP: | 1.04120 |
2,6-di-tert-butyl-4-methylpyridine
methyltriphenylbismuthonium tetrafluoroborate
isopropyl alcohol
A
isopropyl methyl ether
B
2,6-di-tert-butyl-4-methylpyridinium tetrafluoroborate
C
triphenylbismuthane
Conditions | Yield |
---|---|
In chloroform-d1 alcohol was added to mixt. (Ph3BiMe)(BF4) and 2,6-di-tert-butyl-4-methylpyridine in CDCl3 and allowed to react at 23°C for 4-7 h; detn. by NMR; | A 82% B 100% C 100% |
methanol
isopropyloxy(diphenyl)-λ6-sulfanenitrile
A
isopropyl methyl ether
B
S,S-diphenylsulphoximine
Conditions | Yield |
---|---|
at 45℃; for 114h; | A 99% B n/a |
Conditions | Yield |
---|---|
In N,N-dimethyl-formamide for 48h; Heating; | 66% |
ethyl methyl ether
diazomethane-d2
A
diethyl ether
B
isopropyl methyl ether
C
ethene
D
Dimethyl ether
E
methyl propyl ether
Conditions | Yield |
---|---|
Product distribution; Mechanism; Ambient temperature; Irradiation; deuterium distribution; | A 29.7% B 17.9% C n/a D 37.2% E 15.2% |
diazomethane
ethyl methyl ether
A
diethyl ether
B
isopropyl methyl ether
C
ethene
D
methyl propyl ether
Conditions | Yield |
---|---|
Product distribution; Mechanism; Ambient temperature; Irradiation; | A 34% B 33.2% C n/a D 32.8% |
Conditions | Yield |
---|---|
With isopropyl alcohol |
diazomethane
aluminum isopropoxide
isopropyl alcohol
isopropyl methyl ether
diazomethane
isopropyl alcohol
A
isopropyl methyl ether
B
ethene
C
iso-butanol
D
tert-butyl alcohol
Conditions | Yield |
---|---|
bei der Einw. von Sonnenlicht; |
Conditions | Yield |
---|---|
With 1,2-dimethoxyethane; naphthalene; sodium Behandlung der Loesung mit Dimethylsulfat unterhalb 20grad; |
This chemical is called Ether, isopropyl methyl, and its CAS registry number is 598-53-8. With the molecular formula of C4H10O, its molecular weight is 74.12. It's often used as pharmaceutical intermediates.
Other characteristics of the Ether, isopropyl methyl can be summarised as followings: (1)ACD/LogP: 0.80; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.8; (4)ACD/LogD (pH 7.4): 0.8; (5)ACD/BCF (pH 5.5): 2.38; (6)ACD/BCF (pH 7.4): 2.38; (7)ACD/KOC (pH 5.5): 64.68; (8)ACD/KOC (pH 7.4): 64.68; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.358; (14)Molar Refractivity: 22.28 cm3; (15)Molar Volume: 101.3 cm3; (16)Polarizability: 8.83×10-24cm3; (17)Surface Tension: 17.8 dyne/cm; (18)Density: 0.731 g/cm3; (19)Flash Point: °C; (20)Enthalpy of Vaporization: 26.05 kJ/mol; (21)Boiling Point: 50.6 °C at 760 mmHg; (22)Vapour Pressure: 299 mmHg at 25°C.
Production method of this chemical: The Ether, isopropyl methyl could be obtained by the reactants of iodomethane and propan-2-ol; aluminium salt. This reaction needs the solvent of dimethylformamide. The yield is 66 %. In addition, this reaction should be taken for 2 days. The other condition is heating.
Uses of this chemical: The Ether, isopropyl methyl could react with 2-[(R)-3-(benzyloxy)tetradecanamido]-2-deoxy-D-glucose, and obtain the 2-[(R)-3-(benzyloxy)tetradecanamido]-2-deoxy-4,6-O-isopropylidene-D-glucopyranose. This reaction needs the reagent of p-toluenesulfonic acid, molecular sieves 4A, and the solvent of dimethylformamide. The yield is 60 %. In addition, this reaction should be taken for 1 hour at the ambient temperature.
You can still convert the following datas into molecular structure:
1.SMILES: O(C(C)C)C
2.InChI: InChI=1/C4H10O/c1-4(2)5-3/h4H,1-3H3
3.InChIKey: RMGHERXMTMUMMV-UHFFFAOYAB
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LC50 | inhalation | 407gm/m3/15M (407000mg/m3) | BEHAVIORAL: GENERAL ANESTHETIC | Anesthesiology. Vol. 11, Pg. 455, 1950. Link to PubMed |