Toluene diisocyanate manufacturer Knowledge Piperidolate Hydrochloride Piperidolate Hydrochloride

Piperidolate Hydrochloride Piperidolate Hydrochloride

Peridoester Hydrochloride Structural Formula

Structural formula

Business number 03M6
Molecular formula C21H26ClNO2
Molecular weight 359.90
label

Diheperdone,

aromatic compounds

Numbering system

CAS number:129-77-1

MDL number:MFCD00057377

EINECS number:204-964-5

RTECS number:None

BRN number:None

PubChem ID:None

Physical property data

1. Characteristics: colorless flammable liquid.


2. Density (g/mL ,25/4℃): 0.7681


3. Refractive index (n D20): 1.3900


4. Flashpoint ():-15


5. Melting point ():-112


6. Boiling point (ºC):83


7. Solubility:Easily soluble in ethanol and ether, slightly soluble in water.


8. Stability:Chemically active, easy to undergo addition and polymerization reactions, easily hydrolyzed by acids into acetaldehyde and Isobutanol.

Toxicological data


1, acute toxicity: rat intravenously LD5O: 19mg/kg


Mice orally LD5O: 1040mg/kg


Mouse transvenous LD5O: 26mg/kg


Dog Meridian VeinLD5O35mg/kg



Ecological data

None yet

Molecular structure data

None yet

Compute chemical data

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

2. Number of hydrogen bond donors: 1

3. Number of hydrogen bond acceptors: 3

4. Number of rotatable chemical bonds: 6

5. Number of tautomers: none

6. Topological molecule polar surface area 29.5

7. Number of heavy atoms: 25

8. Surface charge: 0

9. Complexity: 367

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 1

13. Determine the number of chemical bond stereocenters: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 2

Properties and stability

None yet

Storage method

None yet

Synthesis method

Introduction to production methods

Produced by the base-catalyzed addition of acetylene and isobutanol.

Purpose

Usage

Used as polymer monomer and organic synthesis intermediate.

AMILY: Times New Roman; mso-list: Ignore”>8. Stability:Reactive chemical properties, prone to addition and polymerization reactions, and easily hydrolyzed by acids into acetaldehyde and isobutanol.

Toxicological data


1, acute toxicity: rat intravenously LD5O: 19mg/kg


Mice orally LD5O: 1040mg/kg


Mouse transvenous LD5O: 26mg/kg


Dog Meridian VeinLD5O35mg/kg



Ecological data

None yet

Molecular structure data

None yet

Compute chemical data

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

2. Number of hydrogen bond donors: 1

3. Number of hydrogen bond acceptors: 3

4. Number of rotatable chemical bonds: 6

5. Number of tautomers: none

6. Topological molecule polar surface area 29.5

7. Number of heavy atoms: 25

8. Surface charge: 0

9. Complexity: 367

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 1

13. Determine the number of chemical bond stereocenters: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 2

Properties and stability

None yet

Storage method

None yet

Synthesis method

Introduction to production methods

Produced by the base-catalyzed addition of acetylene and isobutanol.

Purpose

Usage

Used as polymer monomer and organic synthesis intermediate.

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