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Basic Information
CAS No.: 150407-69-5
Name: (S)-N-4-BOC-N-1-CBZ-2-PIPERAZINE CARBOXYLIC ACID
Article Data: 6
Molecular Structure:
Molecular Structure of 150407-69-5 ((S)-N-4-BOC-N-1-CBZ-2-PIPERAZINE CARBOXYLIC ACID)
Formula: C18H24 N2 O6
Molecular Weight: 364.398
Synonyms: 1,2,4-Piperazinetricarboxylicacid, 4-(1,1-dimethylethyl) 1-(phenylmethyl) ester, (S)-
Density: 1.272g/cm3
Boiling Point: 518.9°Cat760mmHg
Flash Point: 267.6°C
PSA: 96.38000
LogP: 2.20490
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Chemistry

Molecular Structure of (S)-N-4-Boc-N-1-Cbz-2-Piperazinecarboxylic acid (CAS No.150407-69-5):
 
Molecular Formula: C18H24N2O6
Molecular Weight: 364.39
CAS No: 150407-69-5
H bond acceptors: 8
H bond donors: 1
Freely Rotating Bonds: 6
Polar Surface Area: 85.38 Å2
Index of Refraction: 1.555
Molar Refractivity: 91.93 cm3
Molar Volume: 286.3 cm3
Surface Tension: 53.6 dyne/cm
Density: 1.272 g/cm3
Flash Point: 267.6 °C
Enthalpy of Vaporization: 83.33 kJ/mol
Boiling Point: 518.9 °C at 760 mmHg
Vapour Pressure: 1.36E-11 mmHg at 25°C
Systematic Name: (2S)-1-[(Benzyloxy)carbonyl]-4-(tert-butoxycarbonyl)piperazine-2-carboxylic acid 
InChI: InChI=1/C18H24N2O6/c1-18(2,3)26-16(23)19-9-10-20(14(11-19)15(21)22)17(24)25-12-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3,(H,21,22)/t14-/m0/s1
InChIKey: MKXMXZZARNRMMQ-AWEZNQCLBQ
Std. InChI: InChI=1S/C18H24N2O6/c1-18(2,3)26-16(23)19-9-10-20(14(11-19)15(21)22)17(24)25-12-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3,(H,21,22)/t14-/m0/s1
Std. InChIKey: MKXMXZZARNRMMQ-AWEZNQCLSA-N
Product Categories: Piperazines

Specification

   (S)-N-4-Boc-N-1-Cbz-2-Piperazinecarboxylic acid (CAS No.150407-69-5), it also can be called (S)-Piperazine-1,2,4-tricarboxylic acid 1-benzyl ester 4-tert-butyl ester .