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CAS No.: | 1022128-82-0 |
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Name: | 1-(4-Aminophenyl)piperazin-2-one |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C10H13N3O |
Molecular Weight: | 191.233 |
Synonyms: | 1-(4-Aminophenyl)piperazin-2-one |
Density: | 1.221 g/cm3 |
Boiling Point: | 499.1 °C at 760 mmHg |
Flash Point: | 255.6 °C |
PSA: | 58.36000 |
LogP: | 1.18000 |
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The 1-(4-Aminophenyl)piperazin-2-one], with the CAS registry number 1022128-82-0, is also known as 2-Piperazinone, 1-(4-aminophenyl)-. It belongs to the product category of Amines and Anilines. This chemical's molecular formula is C10H13N3O and molecular weight is 191.11. What's more, its systematic name is called 1-(4-Aminophenyl)piperazin-2-one.
Physical properties about 1-(4-Aminophenyl)piperazin-2-one] are: (1)# of Rule of 5 Violations: 0; (2)#H bond acceptors: 4; (3)#H bond donors: 3; (4)#Freely Rotating Bonds: 2; (5)Polar Surface Area: 58.36 Å2; (6)Index of Refraction: 1.608; (7)Molar Refractivity: 54.17 cm3; (8)Molar Volume: 156.5 cm3; (9)Surface Tension: 52.9 dyne/cm; (10)Density: 1.221 g/cm3; (11)Flash Point: 255.6 °C; (12)Enthalpy of Vaporization: 76.74 kJ/mol; (13)Boiling Point: 499.1 °C at 760 mmHg; (14)Vapour Pressure: 4.27E-10 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: c1cc(ccc1N)N2CCNCC2=O
(2) InChI: InChI=1S/C10H13N3O/c11-8-1-3-9(4-2-8)13-6-5-12-7-10(13)14/h1-4,12H,5-7,11H2
(3) InChIKey: MULQTIPGVGXHBL-UHFFFAOYSA-N