3-Methoxybutyl acetate
CAS NO. 4435-53-4
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To begin with, let us tell you what is the basic information of 3-Methoxybutyl acetate Cas No. 4435-53-4 ?
Flash Point |
55.9±14.2 °C |
Molecular Weight |
146.184 |
Density |
0.9±0.1 g/cm3 |
Boiling Point |
175.3±23.0 °C at 760 mmHg |
Molecular Formula |
C7H14O3 |
Exact Mass |
146.094299 |
Like many stuff, it has many synonyms as follows
MFCD00043928 |
EINECS 224-644-9 |
UNII:2W0NXC23XW |
3-Methoxybutyl acetate |
1-Butanol, 3-methoxy-, acetate |
The chemical is very special
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Second, the Synthetic Route we will recommend is the most important for your reference?
Molecular structure data
1. Molar refractive index: 37.95
2. Molar volume (cm3/mol): 154.3
3. Isometric volume (90.2K): 352.4
4. Surface tension (dyne/cm): 27.2
5. Polarization rate (10-24cm3): 15.04
Computational Chemistry Data
1. Reference value for hydrophobic parameter calculation (XlogP): 0.8
2. Number of hydrogen bond donors: 0
3. Number of hydrogen bond receptors: 3
4. Number of rotatable chemical bonds: 5
5. Number of tautomers: None
6. Topological molecule polarity surface area 35.5
7. Number of heavy atoms: 10
8. Surface charge: 0
9. Complexity: 101
10. Number of Isotope Atoms: 0
11. Determine the number of atomic structure centers: 0
12. Number of uncertain atomic structure centers: 1
13. Determine the number of chemical bond stereocenters: 0
14. Number of uncertain chemical bond stereocenters: 0
15. Number of covalent bond units: 1
First, synthesis line of 3-Methoxybutyl acetate Cas No. 4435-53-4 as follows
Refining method: Contains impurities such as free acids and alcohols. When refining, wash with saturated aqueous solution of sodium bicarbonate or sodium carbonate, then wash with aqueous solution of sodium chloride, dry anhydrous sodium sulfate or magnesium sulfate, and distill.
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Third, what is the usage of 3-Methoxybutyl acetate Cas No. 4435-53-4 ? pleas see below
Main Usage:
Mainly used as a solvent for nitrocellulose, ethyl cellulose, etc., and can also be mixed with diluents and paint solvents for use
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Other usages as below
1) Acetic acid (3-methoxybutyl) ester can be used as a synthesis method for the intermediate 2-butyraldehyde, including the following steps:
A: Add 2mol of 1-bromo-2-butyne and 900ml of anhydrous butyl ether solution to the reaction vessel, control the stirring speed at 130rpm, control the solution temperature to 10 ℃, and add 2mol of lanthanum oxide powder in batches for 90 minutes of reaction;
B: Then add 2mol of anhydrous acetic acid (3-methoxybutyl) ester solution, raise the solution temperature to 20 ℃, react for 50min, add 1.3L of anhydrous 2,4-dimethylsulfolane solution, reflux for 2h, wash with anhydrous N, N-dimethylacetamide solution 2 times, wash with anhydrous diethylene glycol dimethyl ether solution 4 times, recrystallize in anhydrous dihexylamine solution, dehydrate with anhydrous potassium carbonate dehydrator, and obtain 116.96g of finished 2-butanal with a yield of 86%.
2) Preparation of resin (A-1):
Firstly, add 235g of bisphenol fluorene type epoxy resin (epoxy equivalent 235), 110mg of tetramethylammonium chloride, 100mg of 2,6-di-tert-butyl-4-methylphenol, and 72.0g of acrylic acid to a 500ml four necked flask. Blow in air at a rate of 25ml/minute and heat to dissolve at 90-100 ℃. Then, slowly heat up the solution in a white and turbid state to 120 ℃ to completely dissolve it. At this point, the solution gradually becomes transparent and viscous, and continues to stir while still in place. Measure the acid value during this period and continue heating and stirring until it is less than 1.0mgKOH/g. It takes 12 hours before the acid value reaches the target value. Afterwards, it was cooled to room temperature to obtain a colorless, transparent, and solid bisphenol fluorene type epoxy acrylate. Then, 600g of acetic acid (3-methoxybutyl) ester was added to 307.0g of the obtained bisphenol fluorene type epoxy acrylate and dissolved. Then, 80.5g of benzophenone tetracarboxylic anhydride and 1g of tetraethyl ammonium bromide were mixed, and the temperature was slowly raised. The reaction was carried out at 110-115 ℃ for 4 hours. After confirming the disappearance of the anhydride group, 38.0g of 1,2,3,6-tetrahydrophthalic anhydride was mixed and reacted at 90 ℃ for 6 hours to obtain resin (A-1).
Besides Safety Information of 3-Methoxybutyl acetate Cas No. 4435-53-4 is also important when handling it
Hazard Codes |
Xi |
H.S. Code |
2915390090 |
What is the appearance of 3-Methoxybutyl acetate Cas No. 4435-53-4 ? Please see the picture of 3-Methoxybutyl acetate Cas No. 4435-53-4, below
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Specification of 3-Chloropropyl acetate Cas No. 628-09-1, is below
Apperance: colorless clear liquid
Assay: 99 % min by GC
IR identity: conform
Water by KF:0.5% max.
HNMR picture of 3-Methoxybutyl acetate Cas No. 4435-53-4 is as follows,
Reference of Article cited for your reference below,
(1)
Publication Name: Analytical sciences : the international journal of the Japan Society for Analytical Chemistry
Publication Date: 2012-12-10
PMID: 23232239
(2)
Einstufung wassergefährdender Stoffe
Publication Name: Bundesgesundheitsblatt - Gesundheitsforschung - Gesundheitsschutz
Publication Date: 1999-04-20
(3)
Publication Name: European Food Research and Technology
Publication Date: 2022-05-16