Molecular Structure of Piperazine,1-methyl-4-(3-nitrophenyl)- (CAS NO.148546-97-8):
Empirical Formula: C11H15N3O2
Molecular Weight: 221.2557
H bond acceptors: 5
H bond donors: 0
Freely Rotating Bonds: 2
Polar Surface Area: 52.3 Å2
Index of Refraction: 1.578
Molar Refractivity: 61.278 cm3
Molar Volume: 184.597 cm3
Surface Tension: 47.328 dyne/cm
Density: 1.199 g/cm3
Flash Point: 166.595 °C
Enthalpy of Vaporization: 59.66 kJ/mol
Boiling Point: 351.852 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C
Melting point: 59.5-62.5°C
SMILES: CN1CCN(CC1)c2cc(ccc2)N(=O)=O
InChI: InChI=1/C11H15N3O2/c1-12-5-7-13(8-6-12)10-3-2-4-11(9-10)14(15)16/h2-4,9H,5-8H2,1H3
Hazard Codes: Xi
Hazard Note: Irritant
Piperazine,1-methyl-4-(3-nitrophenyl)- , with CAS number of 148546-97-8, can be called 1-methyl-4-(3-nitrophenyl)piperazine ; 1-Methyl-4-(3-nitro-phenyl)-piperazine ; 1-Methyl-4-(3-nitrophenyl)piperazine 97% .
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