2-[(3,5-Di-tert-butyl-4-hydroxyphenyl)thio]hexanoic acid
[CAS# 53602-61-2]

Identification

• Name: 2-[(3,5-Di-tert-butyl-4-hydroxyphenyl)thio]hexanoic acid
• Synonyms: 2-(3,5-Ditert-Butyl-4-Hydroxy-Phenyl)Sulfanylhexanoic Acid; 2-[(3,5-Ditert-Butyl-4-Hydroxyphenyl)Thio]Hexanoic Acid; 2-[(3,5-Ditert-Butyl-4-Hydroxy-Phenyl)Thio]Hexanoic Acid
• Molecular Formula: C₂₀H₃₂O₃S
• Molecular Weight: 352.53
• CAS Registry Number: 53602-61-2
• SMILES: C1=C(SC(C(=O)O)CCCC)C=C(C(=C1C(C)(C)C)O)C(C)(C)C
• InChI: 1S/C20H32O3S/c1-8-9-10-16(18(22)23)24-13-11-14(19(2,3)4)17(21)15(12-13)20(5,6)7/h11-12,16,21H,8-10H2,1-7H3,(H,22,23)
• InChIKey: CQGSORMFKDTILR-UHFFFAOYSA-N

Properties

• Density: 1.085g/cm³ (Cal.)
• Boiling point: 442.471°C at 760 mmHg (Cal.)
• Flash point: 221.399°C (Cal.)