2,3-Dimethyl-5-[(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-Nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-Nonaenyl]Benzene-1,4-Diol
[CAS# 3819-09-8]

Identification

• Name: 2,3-Dimethyl-5-[(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-Nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-Nonaenyl]Benzene-1,4-Diol
• Synonyms: 2,3-Dimethyl-5-[(2E,6E,10E,14E,18E,22E,26E,30E)-3,7,11,15,19,23,27,31,35-Nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-Nonaenyl]Hydroquinone; (All-E)-2,3-Dimethyl-5-(3,7,11,15,19,23,27,31,35-Nonamethyl-2,6,10,14,18,22,26,30,34-Hexatricontan Onaenyl)-1,4-Benzenediol; Plastoquinol
• Molecular Formula: C₅₃H₈₂O₂
• Molecular Weight: 751.23
• CAS Registry Number: 3819-09-8
• SMILES: C1=C(O)C(=C(C(=C1C\C=C(\CC\C=C(\CC/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CCC=C(C)C)C)C)C)C)C)C)C)C)O)C)C
• InChI: 1S/C53H82O2/c1-40(2)21-13-22-41(3)23-14-24-42(4)25-15-26-43(5)27-16-28-44(6)29-17-30-45(7)31-18-32-46(8)33-19-34-47(9)35-20-36-48(10)37-38-51-39-52(54)49(11)50(12)53(51)55/h21,23,25,27,29,31,33,35,37,39,54-55H,13-20,22,24,26,28,30,32,34,36,38H2,1-12H3/b41-23+,42-25+,43-27+,44-29+,45-31+,46-33+,47-35+,48-37+
• InChIKey: IJBLJLREWPLEPB-IQSNHBBHSA-N

Properties

• Density: 0.936g/cm³ (Cal.)
• Boiling point: 796.971°C at 760 mmHg (Cal.)
• Flash point: 267.606°C (Cal.)