[3-[(4-Tert-Butylphenoxy)Methyl]-2-Methyl-6-Propylphenyl] Hydrogen Sulfite
[CAS# 3376-90-7]

Identification

• Name: [3-[(4-Tert-Butylphenoxy)Methyl]-2-Methyl-6-Propylphenyl] Hydrogen Sulfite
• Synonyms: [3-[(4-Tert-Butylphenoxy)Methyl]-2-Methyl-6-Propyl-Phenyl] Hydrogen Sulfite; C 940; Ent 27,224
• Molecular Formula: C₂₁H₂₈O₄S
• Molecular Weight: 376.51
• CAS Registry Number: 3376-90-7
• SMILES: C1=C(C(=C(C(=C1)COC2=CC=C(C=C2)C(C)(C)C)C)O[S](=O)O)CCC
• InChI: 1S/C21H28O4S/c1-6-7-16-8-9-17(15(2)20(16)25-26(22)23)14-24-19-12-10-18(11-13-19)21(3,4)5/h8-13H,6-7,14H2,1-5H3,(H,22,23)
• InChIKey: DBFUGGKBJXFJMX-UHFFFAOYSA-N

Properties

• Density: 1.173g/cm³ (Cal.)
• Boiling point: 541.055°C at 760 mmHg (Cal.)
• Flash point: 281.02°C (Cal.)