3-[(1E)-2-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-2-naphthalenyl)-1-propen-1-yl]benzoic acid
[CAS# 89315-17-3]

Identification

• Name: 3-[(1E)-2-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-2-naphthalenyl)-1-propen-1-yl]benzoic acid
• Synonyms: 3-[(E)-2-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-propenyl]-benzoic acid; Benzoic acid, 3-(2-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-1-propenyl)-, (E)-; Ro 19-4788
• Molecular Formula: C₂₄H₂₈O₂
• Molecular Weight: 348.48
• CAS Registry Number: 89315-17-3
• SMILES: C/C(=C\C1=CC(=CC=C1)C(=O)O)/C2=CC3=C(C=C2)C(CCC3(C)C)(C)C
• InChI: 1S/C24H28O2/c1-16(13-17-7-6-8-19(14-17)22(25)26)18-9-10-20-21(15-18)24(4,5)12-11-23(20,2)3/h6-10,13-15H,11-12H2,1-5H3,(H,25,26)/b16-13+
• InChIKey: FWELAWCPFZMRQA-DTQAZKPQSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 490.6±44.0°C at 760 mmHg (Cal.)
• Flash point: 229.9±23.1°C (Cal.)