(2R)-2-(thiophen-2-yl)piperazine

• ChemBase ID: 807901
• Molecular Formular: C8H12N2S
• Molecular Mass: 168.25928
• Monoisotopic Mass: 168.07211939
• SMILES: [C@@H]1(CNCCN1)c1sccc1
• Canonical SMILES: C1CN[C@H](CN1)c1cccs1
• InChI: InChI=1S/C8H12N2S/c1-2-8(11-5-1)7-6-9-3-4-10-7/h1-2,5,7,9-10H,3-4,6H2/t7-/m1/s1
• InChIKey: BFVCDPJJFUPNAQ-SSDOTTSWSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2R)-2-(thiophen-2-yl)piperazine
• IUPAC Traditional name: (2R)-2-(thiophen-2-yl)piperazine
• Synonyms: (R)-2-THIOPHEN-2-YL-PIPERAZINE

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -2.0132499
• LogD (pH = 7.4): -0.41898814
• Log P: 0.9683147
• Molar Refractivity: 46.6215 cm^3
• Polarizability: 18.66454 Å^3
• Polar Surface Area: 24.06 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%