4-[3-[3-[2-(1-Hydroxycyclohexyl)Ethyl]-4-Oxo-1,3-Thiazolidin-2-Yl]Propyl]Benzoic Acid
[CAS# 72313-44-1]

Identification

• Name: 4-[3-[3-[2-(1-Hydroxycyclohexyl)Ethyl]-4-Oxo-1,3-Thiazolidin-2-Yl]Propyl]Benzoic Acid
• Synonyms: 4-[3-[3-[2-(1-Hydroxycyclohexyl)Ethyl]-4-Oxo-Thiazolidin-2-Yl]Propyl]Benzoic Acid; 4-[3-[3-[2-(1-Hydroxycyclohexyl)Ethyl]-4-Oxo-2-Thiazolidinyl]Propyl]Benzoic Acid; 4-[3-[3-[2-(1-Hydroxycyclohexyl)Ethyl]-4-Keto-Thiazolidin-2-Yl]Propyl]Benzoic Acid
• Molecular Formula: C₂₁H₂₉NO₄S
• Molecular Weight: 391.52
• CAS Registry Number: 72313-44-1
• SMILES: C3=C(CCCC1SCC(=O)N1CCC2(O)CCCCC2)C=CC(=C3)C(=O)O
• InChI: 1S/C21H29NO4S/c23-18-15-27-19(22(18)14-13-21(26)11-2-1-3-12-21)6-4-5-16-7-9-17(10-8-16)20(24)25/h7-10,19,26H,1-6,11-15H2,(H,24,25)
• InChIKey: BCZCFHAXZSPKAV-UHFFFAOYSA-N

Properties

• Density: 1.229g/cm³ (Cal.)
• Boiling point: 624.741°C at 760 mmHg (Cal.)
• Flash point: 331.631°C (Cal.)