2-[4-[(E)-1-(4-Chlorophenyl)-2-Phenylbut-1-Enyl]Phenoxy]-N,N-Dimethylethanamine
[CAS# 77588-46-6]

Identification

• Name: 2-[4-[(E)-1-(4-Chlorophenyl)-2-Phenylbut-1-Enyl]Phenoxy]-N,N-Dimethylethanamine
• Synonyms: 2-[4-[(E)-1-(4-Chlorophenyl)-2-Phenyl-But-1-Enyl]Phenoxy]-N,N-Dimethyl-Ethanamine; 2-[4-[(E)-1-(4-Chlorophenyl)-2-Phenyl-But-1-Enyl]Phenoxy]Ethyl-Dimethyl-Amine; 4-Chlorotamoxifen
• Molecular Formula: C₂₆H₂₈ClNO
• Molecular Weight: 405.97
• CAS Registry Number: 77588-46-6
• SMILES: C3=C(\C(=C(C1=CC=CC=C1)\CC)C2=CC=C(Cl)C=C2)C=CC(=C3)OCCN(C)C
• InChI: 1S/C26H28ClNO/c1-4-25(20-8-6-5-7-9-20)26(21-10-14-23(27)15-11-21)22-12-16-24(17-13-22)29-19-18-28(2)3/h5-17H,4,18-19H2,1-3H3/b26-25-
• InChIKey: HKUVASGVWSXQDV-QPLCGJKRSA-N

Properties

• Density: 1.103g/cm³ (Cal.)
• Boiling point: 507.963°C at 760 mmHg (Cal.)
• Flash point: 261.007°C (Cal.)