4-Chlorobutyl acetate
CAS NO. 6962-92-1
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To begin with, let us tell you what is the basic information of 4-Chlorobutyl acetate Cas No. 6962-92-1 ?
Molecular Weight |
150.603 |
CAS Number |
6962-92-1 |
Density |
1.1±0.1 g/cm3 |
Boiling Point |
194.9±0.0 °C at 760 mmHg |
Molecular Formula |
C6H11ClO2 |
Flash Point |
64.4±0.0 °C |
Like many stuff, it has many synonyms as follows
EINECS 230-158-8 |
4-Chlorobutyl acetate |
ω-Chlorobutyl acetate |
MFCD00001013 |
1-Butanol, 4-chloro-, acetate
The chemical is very special
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Molecular structure data
1. Molar refractive index: 36.47
2. Molar volume (m3/mol): 142.4
3. Isometric volume (90.2K): 334.0
4. Surface tension (dyne/cm): 30.2
5. Polarization rate (10-24cm3): 14.45
Computational Chemistry Data
1. Reference value for hydrophobic parameter calculation (XlogP): None
2. Number of hydrogen bond donors: 0
3. Number of hydrogen bond receptors: 2
4. Number of rotatable chemical bonds: 5
5. Number of tautomers: None
6. Topological molecule polarity surface area 26.3
7. Number of heavy atoms: 9
8. Surface charge: 0
9. Complexity: 83.1
10. Number of Isotope Atoms: 0
11. Determine the number of atomic structure centers: 0
12. Number of uncertain atomic structure centers: 0
13. Determine the number of chemical bond stereocenters: 0
14. Number of uncertain chemical bond stereocenters: 0
15. Number of covalent bond units: 1
Second, the Synthetic Route we will recommend is the most important for your reference?
First, synthesis line of 4-Chlorobutyl acetate Cas No. 6962-92-1 as follows
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Third, what is the usage of 4-Chlorobutyl acetate Cas No. 6962-92-1 ? pleas see below
Main Usage:
Intermediates of organic synthesis and pharmaceutical industry.
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Other usages as below
One kind of raw material for producing 1,4-Butanediol,1,4-diacetate cas no 628-67-1,which is as follows
One kind of raw material for producing 3-fluorobutyl acetate cas no 121824-90-6 , which is as follows
Besides Safety Information of 4-Chlorobutyl acetate Cas No. 6962-92-1 is also important when handling it
Hazard Codes |
Xi |
H.S. Code |
2915907098 |
What is the appearance of 4-Chlorobutyl acetate Cas No. 6962-92-1 ? Please see the picture of 4-Chlorobutyl acetate Cas No. 6962-92-1, below
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Specification of 4-Chlorobutyl acetate Cas No. 6962-92-1, is below
Apperance: colorless clear liquid
Assay: 98 % min by GC
IR identity: conform
Water by KF:0.5% max.
HNMR picture of 4-Chlorobutyl acetate Cas No. 6962-92-1 is as follows,
Reference of Article cited for your reference below,
(1)
Publication Name: Chemical Research in Chinese Universities
Publication Date: 2023-04-19
PMID: 37303471
DOI: 10.1007/s40242-023-3030-4
(2)
Publication Name: Korean Journal of Chemical Engineering
Publication Date: 2013-02-12
DOI: 10.1007/s11814-012-0215-9
(3)
Synthesis of chloroesters by the reaction of ethers with acyl chlorides catalyzed by ZnO
Publication Name: Chemical Papers
Publication Date: 2020-07-07