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502649-25-4

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Basic Information
CAS No.: 502649-25-4
Name: N-1-Boc-3-phenylpiperazine
Article Data: 7
Molecular Structure:
Molecular Structure of 502649-25-4 (N-1-Boc-3-phenylpiperazine)
Formula: C15H22N2O2
Molecular Weight: 262.352
Synonyms: 3-Phenylpiperazine-1-carboxylicacid tert-butyl ester;
Density: 1.071 g/cm3
Boiling Point: 371.4 °C at 760 mmHg
Flash Point: 178.4 °C
Hazard Symbols: IrritantXi
PSA: 41.57000
LogP: 2.83470
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    3-PHENYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER

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Chemistry

Product Name: N-1-Boc-3-phenylpiperazine (CAS NO.502649-25-4)

Molecular Formula: C15H22N2O2
Molecular Weight: 262.35g/mol
Mol File: 502649-25-4.mol
Boiling point: 371.4 °C at 760 mmHg
Flash Point: 178.4 °C
Density: 1.071 g/cm3
Surface Tension: 38.2 dyne/cm
Enthalpy of Vaporization: 61.85 kJ/mol
Vapour Pressure: 1.03E-05 mmHg at 25°C
XLogP3-AA: 2
H-Bond Donor: 1
H-Bond Acceptor: 3
Structure Descriptors of N-1-Boc-3-phenylpiperazine (CAS NO.502649-25-4):
  IUPAC Name: tert-butyl 3-phenylpiperazine-1-carboxylate
  Canonical SMILES: CC(C)(C)OC(=O)N1CCNC(C1)C2=CC=CC=C2
  InChI: InChI=1S/C15H22N2O2/c1-15(2,3)19-14(18)17-10-9-16-13(11-17)12-7-5-4-6-8-12/h4-8,13,16H,9-11H2,1-3H3 
  InChIKey: HRRFJZULVYGVNJ-UHFFFAOYSA-N
Product Categories: Pyrans, Piperidines &Piperazines; Pyrans, Piperidines & Piperazines

Safety Profile

Safety Information of N-1-Boc-3-phenylpiperazine (CAS NO.502649-25-4):
Hazard Codes: XiIrritant
Hazard Note: Irritant

Specification

 N-1-Boc-3-phenylpiperazine , its CAS NO. is 502649-25-4, the synonyms are  3-Phenylpiperazine-1-carboxylic acid tert-butyl ester ; Tert-butyl 3-phenylpiperazine-1-carboxylate .