2-Octyl cyanoacetate

What is 2-Octyl cyanoacetate, cas no. 52688-08-1,a producer telling you the result.

CAS NO. 107-96-0

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To begin with, let us tell you what is the basic information of 2-Octyl cyanoacetate Cas No. 52688-08-1 ?

Flash Point	105.4±5.2 °C	Molecular Weight	197.274
Density	1.0±0.1 g/cm3	Boiling Point	241.4±8.0 °C at 760 mmHg
Molecular Formula	C11H19NO2	Exact Mass	197.141586

Like many stuff, it has many synonyms as follows

2-Octyl cyanoacetate

NC1VOY6&1

Acetic acid, 2-cyano-, 1-methylheptyl ester

Cyanoacetic acid 1-methylheptyl ester

Octan-2-yl 2-cyanoacetate

Cyanoacetic acid isooctyl ester

2-Octanyl cyanoacetate

1-Methylheptyl cyanoacetate

The chemical is very special

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Computational Chemistry Data

1. Reference value for hydrophobic parameter calculation (XlogP): 3.3

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond receptors: 3

4. Number of rotatable chemical bonds: 8

5. Number of tautomers: None

6. Topological molecule polarity surface area: 50.1

7. Number of heavy atoms: 14

8. Surface charge: 0

9. Complexity: 205

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

Second, the Synthetic Route we will recommend is the most important for your reference?

First, synthesis line of 2-Octyl cyanoacetate Cas No. 52688-08-1 as follows

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Other synthesis lines of 2-Octyl cyanoacetate Cas No. 52688-08-1, as follows？

Third, what is the usage of 2-Octyl cyanoacetate Cas No. 52688-08-1 ? pleas see below

Main Usage:

Sec-octyl cyanoacetate is an ester organic compound, which is the main type of clinical application and is widely used in orthodontics and dental repair. It is also widely used in orthopedics as a filling material for artificial joint fixation and bone defects in artificial joint replacement surgery.

Sec-octyl cyanoacetate is the main raw material used for synthesizing a-cyanoacrylate ester adhesives. A-cyanoacrylate adhesive is the earliest discovered and most widely used tissue adhesive, characterized by fast bonding speed, high bonding strength, relatively low toxicity, and relatively weak tissue reactions. It is the main type of adhesive used in clinical practice

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Besides Safety Information of 2-Octyl cyanoacetate Cas No. 52688-08-1 is also important when handling it

Hazard Codes	Xi
H.S. Code	2926909090

What is the appearance of 2-Octyl cyanoacetate Cas No. 52688-08-1 ? Please see the picture of 3-Mercaptopropionic acid Cas No. 107-96-0, below