(4-methoxyphenyl)diphenylmethanol

• ChemBase ID: 295512
• Molecular Formular: C20H18O2
• Molecular Mass: 290.35572
• Monoisotopic Mass: 290.13067982
• SMILES: COc1ccc(cc1)C(c1ccccc1)(c1ccccc1)O
• Canonical SMILES: COc1ccc(cc1)C(c1ccccc1)(c1ccccc1)O
• InChI: InChI=1S/C20H18O2/c1-22-19-14-12-18(13-15-19)20(21,16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-15,21H,1H3
• InChIKey: WCRRRAKYYPJJMP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (4-methoxyphenyl)diphenylmethanol
• IUPAC Traditional name: (4-methoxyphenyl)diphenylmethanol
• Synonyms: p-Anisyl diphenyl carbinol; 4-Methoxytriphenylmethanol; 4-Methoxytrityl alcohol; 4-甲氧基三苯代甲基醇

Database IDs

• CAS Number: 847-83-6
• EC Number: 212-693-9
• MDL Number: MFCD00087962
• PubChem SID: 180681043
• PubChem CID: 70061

CALCULATED PROPERTIES

• Acid pKa: 12.744895
• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 4.4807067
• LogD (pH = 7.4): 4.480705
• Log P: 4.4807067
• Molar Refractivity: 89.7747 cm^3
• Polarizability: 34.527756 Å^3
• Polar Surface Area: 29.46 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• TSCA Listed: 否

Product Information

• Purity: 94%