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| CAS No.: | 23145-91-7 |
|---|---|
| Name: | 1-(3-Chlorobenzyl)piperazine |
| Article Data: | 16 |
| Molecular Structure: | |
|
|
|
| Formula: | C11H15ClN2 |
| Molecular Weight: | 210.706 |
| Synonyms: | Piperazine,1-(m-chlorobenzyl)- (8CI);1-(m-Chlorobenzyl)piperazine;N-(3-Chlorobenzyl)piperazine; |
| Density: | 1.146 g/cm3 |
| Boiling Point: | 303.7 °C at 760 mmHg |
| Flash Point: | 137.5 °C |
| Appearance: | Corrosive liqui |
| Hazard Symbols: |
 C,  Xi
|
| Risk Codes: | 22-34 |
| Safety: | 26-36/37/39-45 |
| Transport Information: | UN 2735 8/PG 3 |
| PSA: | 15.27000 |
| LogP: | 2.01190 |
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Specification
The Piperazine,1-[(3-chlorophenyl)methyl]-, with the CAS registry number 23145-91-7, is also known as 1-(4-Chlorobenzyl)piperazine. It belongs to the product categories of API intermediates; Building Blocks; Halogenated Heterocycles; Heterocyclic Building Blocks; Piperazines; Piperazines Heterocyclic Building Blocks. This chemical's molecular formula is C11H15ClN2 and molecular weight is 210.7. Its systematic name is called 1-(3-chlorobenzyl)piperazine. This chemical is corrosive liquid.
Physical properties of Piperazine,1-[(3-chlorophenyl)methyl]-: (1)ACD/LogP: 1.95; (2)#H bond acceptors: 2; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 2; (5)Index of Refraction: 1.559; (6)Molar Refractivity: 59.42 cm3; (7)Molar Volume: 183.8 cm3; (8)Surface Tension: 41.3 dyne/cm; (9)Density: 1.146 g/cm3; (10)Flash Point: 137.5 °C; (11)Enthalpy of Vaporization: 54.4 kJ/mol; (12)Boiling Point: 303.7 °C at 760 mmHg; (13)Vapour Pressure: 0.000915 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may destroy living tissue on contact and may cause inflammation to the skin or other mucous membranes. It is harmful if swallowed. This chemical may cause burns. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(ccc1)CN2CCNCC2
(2)InChI: InChI=1/C11H15ClN2/c12-11-3-1-2-10(8-11)9-14-6-4-13-5-7-14/h1-3,8,13H,4-7,9H2
(3)InChIKey: JTEQMTYOCBFLNH-UHFFFAOYAZ