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674792-06-4

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Basic Information
CAS No.: 674792-06-4
Name: (S)-1-N-Boc-Isobutylpiperazine
Molecular Structure:
Molecular Structure of 674792-06-4 ((S)-1-N-Boc-Isobutylpiperazine)
Formula: C13H26 N2 O2
Molecular Weight: 242.362
Synonyms: 2-Isobutyl-piperazine-1-carboxylicacid tert-butyl ester; tert-Butyl (2S)-2-isobutylpiperazine-1-carboxylate
Density: 0.962 g/cm3
Boiling Point: 315.5 °C at 760 mmHg
Flash Point: 144.6 °C
Hazard Symbols: IrritantXi
PSA: 38.33000
LogP: 2.28510
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Chemistry

Systematic Name: tert-butyl (2S)-2-(2-Methylpropyl)piperazine-1-carboxylate 
Synonyms of (S)-1-N-Boc-Isobutylpiperazine (CAS NO.674792-06-4): (S)-2-Isobutylpiperazine-1-carboxylic acid tert-butyl ester
CAS NO: 674792-06-4
Molecular Formula: C13H26N2O2 
Molecular Weight: 242.3577
Molecular Structure:
H bond acceptors:  4 
H bond donors:  1 
Freely Rotating Bonds:  4 
Polar Surface Area:  41.57 Å2 
Index of Refraction:  1.458 
Molar Refractivity:  68.72 cm3 
Molar Volume:  251.6 cm3 
Surface Tension:  30.9 dyne/cm 
Density:  0.962 g/cm3 
Flash Point:  144.6 °C 
Enthalpy of Vaporization:  55.68 kJ/mol 
Boiling Point:  315.5 °C at 760 mmHg 
Vapour Pressure:  0.000435 mmHg at 25°C
Product Categories of (S)-1-N-Boc-Isobutylpiperazine (CAS NO.674792-06-4): Piperaizine 
InChI: InChI=1/C13H26N2O2/c1-10(2)8-11-9-14-6-7-15(11)12(16)17-13(3,4)5/h10-11,14H,6-9H2,1-5H3/t11-/m0/s1  InChIKey: WXGGVOBNOVOVAM-NSHDSACABZ 
Std. InChI: InChI=1S/C13H26N2O2/c1-10(2)8-11-9-14-6-7-15(11)12(16)17-13(3,4)5/h10-11,14H,6-9H2,1-5H3/t11-/m0/s1
Std. InChIKey: WXGGVOBNOVOVAM-NSHDSACASA-N

Safety Profile

Hazard Codes: IrritantXi