棉子酚乙酸
[CAS# 5453-04-3]

基本信息

• 产品名称: 棉子酚乙酸
• 英文名: Gossypol Acetic Acid
• 别名: Acetic Acid; 7-(8-Formyl-1,6,7-Trihydroxy-5-Isopropyl-3-Methyl-2-Naphthyl)-2,3,8-Trihydroxy-4-Isopropyl-6-Methyl-Naphthalene-1-Carbaldehyde; Acetic Acid; 7-(8-Formyl-1,6,7-Trihydroxy-5-Isopropyl-3-Methyl-2-Naphthyl)-2,3,8-Trihydroxy-4-Isopropyl-6-Methyl-1-Naphthalenecarboxaldehyde; Ethanoic Acid; 2,3,8-Trihydroxy-6-Methyl-4-Propan-2-Yl-7-(1,6,7-Trihydroxy-8-Methanoyl-3-Methyl-5-Propan-2-Yl-Naphthalen-2-Yl)Naphthalene-1-Carbaldehyde
• 分子式: C₃₂H₃₄O₁₀
• 分子量: 578.61
• CAS 登录号: 5453-04-3
• 分子行输入简码 SMILES: C1=C(C)C(=C(C2=C1C(=C(O)C(=C2C=O)O)C(C)C)O)C4=C(C3=C(C(=C(O)C(=C3C=O)O)C(C)C)C=C4C)O.CC(O)=O
• 国际化学标识码 InChI: 1S/C30H30O8.C2H4O2/c1-11(2)19-15-7-13(5)21(27(35)23(15)17(9-31)25(33)29(19)37)22-14(6)8-16-20(12(3)4)30(38)26(34)18(10-32)24(16)28(22)36;1-2(3)4/h7-12,33-38H,1-6H3;1H3,(H,3,4)
• 国际化学标识检索码 InChIKey: NIOHNDKHQHVLKA-UHFFFAOYSA-N

物理化学性质

• 沸点: 707.9°C at 760 mmHg （计算值）
• 闪点: 395.9°C （计算值）