6-(4-(2-(((4-Chlorophenyl)Sulfonyl)Amino)Ethyl)Phenyl)-6-(3-Pyridinyl)-5-Hexenoic Acid Compd. With Cyclohexanamine (2:1)
[CAS# 133276-53-6]

Identification

• Name: 6-(4-(2-(((4-Chlorophenyl)Sulfonyl)Amino)Ethyl)Phenyl)-6-(3-Pyridinyl)-5-Hexenoic Acid Compd. With Cyclohexanamine (2:1)
• Synonyms: (E)-6-[4-[2-[(4-Chlorophenyl)Sulfonylamino]Ethyl]Phenyl]-6-(3-Pyridyl)Hex-5-Enoic Acid; (E)-6-[4-[2-[(4-Chlorophenyl)Sulfonylamino]Ethyl]Phenyl]-6-(3-Pyridyl)Hex-5-Enoic Acid; Cyclohexanamine; (E)-6-[4-[2-[(4-Chlorophenyl)Sulfonylamino]Ethyl]Phenyl]-6-(3-Pyridyl)Hex-5-Enoic Acid; (E)-6-[4-[2-[(4-Chlorophenyl)Sulfonylamino]Ethyl]Phenyl]-6-(3-Pyridyl)Hex-5-Enoic Acid; Cyclohexylamine
• Molecular Formula: C₅₆H₆₃Cl₂N₅O₈S₂
• Molecular Weight: 1069.17
• CAS Registry Number: 133276-53-6
• SMILES: C3=C([S](=O)(=O)NCCC2=CC=C(\C(C1=CC=CN=C1)=C/CCCC(=O)O)C=C2)C=CC(=C3)Cl.C6=C([S](=O)(=O)NCCC5=CC=C(\C(C4=CC=CN=C4)=C/CCCC(=O)O)C=C5)C=CC(=C6)Cl.C7C(N)CCCC7
• InChI: 1S/2C25H25ClN2O4S.C6H13N/c2*26-22-11-13-23(14-12-22)33(31,32)28-17-15-19-7-9-20(10-8-19)24(5-1-2-6-25(29)30)21-4-3-16-27-18-21;7-6-4-2-1-3-5-6/h2*3-5,7-14,16,18,28H,1-2,6,15,17H2,(H,29,30);6H,1-5,7H2/b2*24-5+
• InChIKey: GCPNGFCWFJEPEO-WTJXDLAJSA-N

Properties

• Boiling point: 704.9°C at 760 mmHg (Cal.)
• Flash point: 380.1°C (Cal.)