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| CAS No.: | 783251-37-6 |
|---|---|
| Name: | 4-PIPERAZINE-2-YL-PHENOL |
| Molecular Structure: | |
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| Formula: | C10H14N2O |
| Molecular Weight: | 178.23 |
| Synonyms: | 4-PIPERAZINE-2-YL-PHENOL;4-PIPERAZIN-2-YL-PHENOL;4-PIPERAZIN-2-YL-PHENOL, 95+%;4-(2-Piperazino)phenol, 95%;4-(2-Piperazinyl)phenol, 95% |
| Density: | 1.106g/cm3 |
| Melting Point: | 204°C |
| Boiling Point: | 356.2 °C at 760 mmHg |
| Flash Point: | 166.2 °C |
| Transport Information: | UN 3263 |
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Specification
The Phenol,4-(2-piperazinyl)-, with CAS registry number 783251-37-6, has the systematic name of 4-(piperazin-2-yl)phenol. Besides this, it is also called 4-(2-Piperazinyl)phenol. And the chemical formula of this chemical is C10H14N2O.
Physical properties of Phenol,4-(2-piperazinyl)-: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 44.29 Å2; (10)Index of Refraction: 1.551; (11)Molar Refractivity: 51.46 cm3; (12)Molar Volume: 161.1 cm3; (13)Polarizability: 20.4×10-24cm3; (14)Surface Tension: 43.6 dyne/cm; (15)Density: 1.106 g/cm3; (16)Flash Point: 166.2 °C; (17)Enthalpy of Vaporization: 62.52 kJ/mol; (18)Boiling Point: 356.2 °C at 760 mmHg; (19)Vapour Pressure: 1.44E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc(cc1)C2CNCCN2
(2)InChI: InChI=1/C10H14N2O/c13-9-3-1-8(2-4-9)10-7-11-5-6-12-10/h1-4,10-13H,5-7H2
(3)InChIKey: SASIFHOHGBPKMK-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C10H14N2O/c13-9-3-1-8(2-4-9)10-7-11-5-6-12-10/h1-4,10-13H,5-7H2
(5)Std. InChIKey: SASIFHOHGBPKMK-UHFFFAOYSA-N