1-(2-Chloroethyl)piperidine hydrochloride

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What is 1-(2-Chloroethyl)piperidine hydrochloride, cas no:2008-75-5,a producer telling you the result.

                                            CAS NO.2008-75-5

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To begin with, let us tell you what is the basic information of 1-(2-Chloroethyl)piperidine hydrochloride ?

Molecular Formula

C7H15Cl2N

Molecular Weight

184.107

Melting Point

230-232 °C(lit.)

Boiling Point

190.3ºC at 760mmHg

Flash Point

68.9ºC

Exact Mass

183.058151

 

Like many stuff, it has many synonyms as follows

MFCD00012837

EINECS 217-920-5

1-(2-chlorethyl)piperidinhydrochlorid

1-(2-Chloroethyl)piperidine hydrochloride (1:1)

Piperidine, 1- (2-chloroethyl)-, hydrochloride

2-Piperidinoethyl Chloride Hydrochloride

2-Chloroethylpiperidine hydrochloride

Piperidine, 1-(2-chloroethyl)-, hydrochloride (1:1)

N-Chloroethyl piperidine hydrochloride

2-Piperidinoethylchloridehydrochloride

Piperidinoethyl chloride,hydrochloride

2-Piperidinoethylchloride Hydrochloride

1-(2-Chloroethyl)piperidinium chloride

1-(2-Chloroethyl)piperidine Hydrochloride

1-(2-CHLORO ETHYL) PIPERIDINE HCL

 

First, the chemical is very special, some technical indexes as below

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Physical property data

1. Appearance: Powder

2. Density (g/mL, 25 º C): undetermined

3. Relative vapor density (g/mL, air=1): not determined

4. Melting point (º C): 228-234

5. Boiling point (º C): undetermined

6. Boiling point (º C, 2mmHg): undetermined

7. Refractive index: undetermined

8. Flash point (° C): undetermined

9. Specific rotation (º F): not determined

10. Spontaneous combustion point or ignition temperature (º C): not determined

11. Vapor pressure (kPa, 20 º C): not determined

12. Saturated vapor pressure (kPa, 25 º C): not determined

13. Combustion heat (KJ/mol): undetermined

14. Critical temperature (º C): not determined

15. Critical pressure (KPa): undetermined

16. Logarithmic value of oil-water (octanol/water) partition coefficient: undetermined

17. Explosion upper limit (%, V/V): undetermined

18. Lower explosive limit (%, V/V): not determined

19. Solubility: soluble in water

 

toxicology data

1. Acute toxicity: intraperitoneal LD50 in mice: 93mg/kg; Subcutaneous LD50 of mice: 125mg/kg; Mouse intravenous LD50: 56mg/kg;

2. Mutagenicity

Microbial Salmonella typhimurium mutation: 5400 μ mol/L;

Escherichia coli mutation: 5400 μ mol/L;

Unplanned DNA synthesis in rat liver: 500 μ mol/L;

Ecological data

It is slightly harmful to water. Do not let undiluted or large amounts of products come into contact with groundwater, waterways, or sewage systems. Do not discharge materials into the surrounding environment without government permission.

Calculate chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): None

2. Number of hydrogen bond donors: 1

3. Number of hydrogen bond acceptors: 1

4. Number of rotatable chemical bonds: 2

5. Number of tautomers: None

6. Topological molecular polarity surface area 3.2

7. Number of heavy atoms: 10

8. Surface charge: 0

9. Complexity: 69.3

10. Number of isotopic atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 0

13. Determine the number of chemical bond stereocenters: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 2

Nature and stability

If used and stored according to specifications, it will not decompose, there are no known hazardous reactions, and oxidation should be avoided

Storage method

Keep the storage container sealed and stored in a cool, dry place, ensuring good ventilation or exhaust in the workspace

 

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

First, synthesis line of 1-(2-Chloroethyl)piperidine hydrochloride CAS NO.2008-75-5  as follows

 

Third, what is the usage of  1-(2-Chloroethyl)piperidine hydrochloride  CAS NO.2008-75-5  pleas see below

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Usage:

It is commonly used in the synthesis of carbamazepine (Carisprodol) and carats! ");

Other usage:

Used for the synthesis of 1-[2-(4-bromophenoxy)ethyl]piperidine Cas no. 836-58-8

Used for the synthesis of phenyl-[4-(2-piperidin-2-ylethoxy)phenyl]methanone Cas no. 102156-42-3

Used for the synthesis of methyl 4-(2-piperidin-1-ylethoxy)benzoate Cas no. 89407-97-6

 

Besides Safety Information of 1-(2-Chloroethyl)piperidine hydrochloride  CAS NO.2008-75-5  is also important when handling it

 

Hazard Codes 

Xi

WGK Germany 

3

HSCode

2933 3990.99

TSCA 

Yes

HazardClass 

IRRITANT

 

 

What is the appearance of 1-(2-Chloroethyl)piperidine hydrochloride  CAS NO.2008-75-5?   Please see the picture of 1-(2-Chloroethyl)piperidine hydrochloride  CAS NO.2008-75-5, below

 

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Specification of 1-(2-Chloroethyl)piperidine hydrochloride  CAS NO.2008-75-5, is below

Apperance: white to off-white crystal powder

Assay: 98 min by HPLC

IR identity: conform

Melting poing: 228-234

IR  picture of  1-(2-Chloroethyl)piperidine hydrochloride  CAS NO.2008-75-5   is as follows,

 

HNMR  picture of  1-(2-Chloroethyl)piperidine hydrochloride  CAS NO.2008-75-5   is as follows,

 

Reference of  Article cited for your reference below,

 

(1)

Synthesis, molecular docking, and apoptogenic efficacy of novel N-heterocycle analogs to target B-cell lymphoma 2/X-linked inhibitors of apoptosis proteins to regress melanoma

Publication Name: Medicinal Chemistry Research

Publication Date: 2019-06-04

DOI: 10.1007/s00044-019-02357-x

(2)

Development of a novel indirubin derivative with enhanced anticancer properties: synthesis, in Vitro, and in Vivo evaluation

Publication Name: Chemical Papers

Publication Date: 2023-12-29

DOI: 10.1007/s11696-023-03253-w

(3)

Synthesis of N1,N1,N3,N3-tetrasubstituted diethylenetriamines

Publication Name: Russian Chemical Bulletin

Publication Date: 2018-05

DOI: 10.1007/s11172-018-2147-y