(2,4,6-三氧代-1,3,5-三嗪-1,3,5(2H,4H,6H)三基三(2,1-乙二 基)三[3,5-二特丁基-4-羟基苯丙酸 酯]
3,5-Di-tert-butyl-4-hydroxyhydrocinnamic acid triester with 1,3,5-tris(2-hydroxyethyl)-S-triazine-2,4,6(1H,3H,5H)-trione · CAS 34137-09-2
- 中文名
- (2,4,6-三氧代-1,3,5-三嗪-1,3,5(2H,4H,6H)三基三(2,1-乙二 基)三[3,5-二特丁基-4-羟基苯丙酸 酯]
- 中文别名
- 暂无
- 英文名
- 3,5-Di-tert-butyl-4-hydroxyhydrocinnamic acid triester with 1,3,5-tris(2-hydroxyethyl)-S-triazine-2,4,6(1H,3H,5H)-trione
- CAS
- 34137-09-2
- CID
- 64868
- IUPAC 名称
- 2-[3,5-bis[2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoyloxy]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate
名称与编号
- 中文名
- (2,4,6-三氧代-1,3,5-三嗪-1,3,5(2H,4H,6H)三基三(2,1-乙二 基)三[3,5-二特丁基-4-羟基苯丙酸 酯]
- 中文别名
- 暂无
- 英文名
- 3,5-Di-tert-butyl-4-hydroxyhydrocinnamic acid triester with 1,3,5-tris(2-hydroxyethyl)-S-triazine-2,4,6(1H,3H,5H)-trione
- CAS
- 34137-09-2
- CID
- 64868
- IUPAC 名称
- 2-[3,5-bis[2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoyloxy]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate
分子属性
- 分子式
- C60H87N3O12
- 分子量
- 1042.3 g/mol
- 精确质量
- 1041.62897522 Da
- 单同位素质量
- 1041.62897522 Da
- XLogP
- 13.7
- 极性表面积
- 201 Ų
- 氢键供体
- 3
- 氢键受体
- 12
- 可旋转键
- 27
- 重原子数
- 75
- 净电荷
- 0
- 结构复杂度
- 1630
结构标识
- InChIKey
- MQRCHVBRBGNZGJ-UHFFFAOYSA-N
- SMILES
- CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)OCCN2C(=O)N(C(=O)N(C2=O)CCOC(=O)CCC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)CCOC(=O)CCC4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C
- InChI
- InChI=1S/C60H87N3O12/c1-55(2,3)40-31-37(32-41(49(40)67)56(4,5)6)19-22-46(64)73-28-25-61-52(70)62(26-29-74-47(65)23-20-38-33-42(57(7,8)9)50(68)43(34-38)58(10,11)12)54(72)63(53(61)71)27-30-75-48(66)24-21-39-35-44(59(13,14)15)51(69)45(36-39)60(16,17)18/h31-36,67-69H,19-30H2,1-18H3