Decapreno-beta-Carotene
[CAS# 5940-03-4]

基本信息

• 产品名称: Decapreno-beta-Carotene
• 英文名: Decapreno-beta-Carotene
• 别名: 2-[(1E,3E,5E,7E,9E,11E,13E,15E,17E,19E,21E,23E,25E)-3,7,11,16,20,24-Hexamethyl-26-(2,6,6-Trimethyl-1-Cyclohexenyl)Hexacosa-1,3,5,7,9,11,13,15,17,19,21,23,25-Tridecaenyl]-1,3,3-Trimethyl-Cyclohexene; Decapreno-Beta-Carotene; Cyclohexene, 1,1'-(3,7,11,16,20,24-Hexamethyl-1,3,5,7,9,11,13,15,17,19,21,23,25-Hexacosatridecaene-1,26-Diyl)Bis(2,6,6-Trimethyl-, (All-E)-
• 分子式: C₅₀H₆₈
• 分子量: 669.09
• CAS 登录号: 5940-03-4
• 分子行输入简码 SMILES: CC1(C(=C(CCC1)C)\C=C\C(=C\C=C\C(=C\C=C\C(=C\C=C\C=C(\C=C\C=C(\C=C\C=C(\C=C\C2=C(CCCC2(C)C)C)C)C)C)C)C)C)C
• 国际化学标识码 InChI: 1S/C50H68/c1-39(23-15-25-41(3)27-17-29-43(5)33-35-47-45(7)31-19-37-49(47,9)10)21-13-14-22-40(2)24-16-26-42(4)28-18-30-44(6)34-36-48-46(8)32-20-38-50(48,11)12/h13-18,21-30,33-36H,19-20,31-32,37-38H2,1-12H3/b14-13+,23-15+,24-16+,27-17+,28-18+,35-33+,36-34+,39-21+,40-22+,41-25+,42-26+,43-29+,44-30+
• 国际化学标识检索码 InChIKey: ODEVCWAIAJCZRJ-MGJPSJOXSA-N

物理化学性质

• 密度: 0.943g/cm³ （计算值）
• 沸点: 771.594°C at 760 mmHg （计算值）
• 闪点: 418.839°C （计算值）

参考文献

• (1): Kildahl-Andersen Geir. Longer polyenyl cations in relation to soliton theory, Organic & Biomolecular Chemistry, 2007