(2R)-2-(4-methoxyphenyl)piperazine

• ChemBase ID: 807808
• Molecular Formular: C11H16N2O
• Molecular Mass: 192.25754
• Monoisotopic Mass: 192.12626314
• SMILES: [C@H]1(CNCCN1)c1ccc(cc1)OC
• Canonical SMILES: COc1ccc(cc1)[C@H]1NCCNC1
• InChI: InChI=1S/C11H16N2O/c1-14-10-4-2-9(3-5-10)11-8-12-6-7-13-11/h2-5,11-13H,6-8H2,1H3/t11-/m0/s1
• InChIKey: INKLSJITWMAFRT-NSHDSACASA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2R)-2-(4-methoxyphenyl)piperazine
• IUPAC Traditional name: (2R)-2-(4-methoxyphenyl)piperazine
• Synonyms: (2R)-2-(4-METHOXYPHENYL)PIPERAZINE

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -2.2116294
• LogD (pH = 7.4): -0.73184335
• Log P: 0.8977621
• Molar Refractivity: 56.1948 cm^3
• Polarizability: 22.54244 Å^3
• Polar Surface Area: 33.29 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%