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CAS No.: | 179756-90-2 |
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Name: | 4-Chloro-2-piperazin-1-yl-pyrimidine |
Molecular Structure: | |
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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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
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 .