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179756-90-2

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Basic Information
CAS No.: 179756-90-2
Name: 4-Chloro-2-piperazin-1-yl-pyrimidine
Molecular Structure:
Molecular Structure of 179756-90-2 (4-Chloro-2-piperazin-1-yl-pyrimidine)
Formula: C8H11 Cl N4
Molecular Weight: 198.655
Synonyms: 1-(4-Chloro-2-pyrimidinyl)piperazine
Density: 1.272g/cm3
Boiling Point: 362.673oC at 760 mmHg
Flash Point: 173.139oC
PSA: 41.05000
LogP: 0.93340
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    4-chloro-2-piperazin-1-yl-pyrimidine CAS No: 179756-90-2 Molecular formula: C8H11ClN4 Molecular weight: 198.65 4-chloro-2-piperazin-1-ylpyrimidine 4-Chloro-2-piperazin-1-ylpyrimidine Use and synthesis method Security Information M

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Chemistry

Molecular structure of 4-Chloro-2-piperazin-1-yl-pyrimidine (CAS NO.179756-90-2) is:

Product Name: 4-Chloro-2-piperazin-1-yl-pyrimidine
CAS Registry Number: 179756-90-2
IUPAC Name: 4-Chloro-2-piperazin-1-ylpyrimidine
Molecular Weight: 198.65274 [g/mol]  
Molecular Formula: C8H11ClN4  
XLogP3-AA: 1  
H-Bond Donor: 1  
H-Bond Acceptor: 4
Index of Refraction: 1.565 
Molar Refractivity: 50.883 cm3 
Molar Volume: 156.132 cm3
Surface Tension: 50.986 dyne/cm 
Density: 1.272 g/cm3 
Flash Point: 173.139 °C 
Enthalpy of Vaporization: 60.865 kJ/mol 
Boiling Point: 362.673 °C at 760 mmHg 
Vapour Pressure: 0 mmHg at 25 °C 
Canonical SMILES: C1CN(CCN1)C2=NC=CC(=N2)Cl
InChI: InChI=1S/C8H11ClN4/c9-7-1-2-11-8(12-7)13-5-3-10-4-6-13/h1-2,10H,3-6H2 
InChIKey: MQSYDNGEAVHZAN-UHFFFAOYSA-N

Specification

 4-Chloro-2-piperazin-1-yl-pyrimidine , its cas register number is 179756-90-2. It also can be called Pyrimidine,4-chloro-2-(1-piperazinyl)- ; 1-(4-Chloro-2-pyrimidinyl)piperazine .