57-oxahexadecacyclo[14.14.14.620,27.634,41.15,12.02,15.04,13.06,11.017,30.019,28.021,26.031,44.033,42.035,40.045,50.051,56]heptapentaconta-2(15),6,8,10,17(30),18,21,23,25,28,31(44),32,35,37,39,42,45,47,49,51,53,55-docosaene | 103960-16-3

分子结构分类

有机化合物 - 苯类化合物 - 四氢化萘

中文名称

——

中文别名

——

英文名称

57-oxahexadecacyclo[14.14.14.620,27.634,41.15,12.02,15.04,13.06,11.017,30.019,28.021,26.031,44.033,42.035,40.045,50.051,56]heptapentaconta-2(15),6,8,10,17(30),18,21,23,25,28,31(44),32,35,37,39,42,45,47,49,51,53,55-docosaene

英文别名

——

57-oxahexadecacyclo[14.14.14.620,27.634,41.15,12.02,15.04,13.06,11.017,30.019,28.021,26.031,44.033,42.035,40.045,50.051,56]heptapentaconta-2(15),6,8,10,17(30),18,21,23,25,28,31(44),32,35,37,39,42,45,47,49,51,53,55-docosaene化学式

CAS

103960-16-3

化学式

C₅₆H₃₈O

mdl

——

分子量

726.917

InChiKey

ZTESRAKGTNEVSF-UHFFFAOYSA-N

BEILSTEIN

——

EINECS

——

计算性质

辛醇/水分配系数(LogP)：

12.4
重原子数：

57.0
可旋转键数：

0.0
环数：

19.0
sp3杂化的碳原子比例：

0.21
拓扑面积：

9.23
氢给体数：

0.0
氢受体数：

1.0

上下游信息

上游原料

中文名称	英文名称	CAS号	化学式	分子量
——	37,38-dimethylidenedodecacyclo[22.6.6.69,16.25,20.02,23.04,21.06,19.08,17.010,15.025,30.031,36.039,44]tetratetraconta-2,4(21),6(19),7,10,12,14,17,22,25,27,29,31,33,35,39,41,43-octadecaene	103960-15-2	C₄₆H₃₀	582.744

下游产品

中文名称	英文名称	CAS号	化学式	分子量
——	pentadecacyclo[14.14.14.65,12.620,27.02,15.04,13.06,11.017,30.019,28.021,26.031,44.033,42.035,40.045,50.051,56]hexapentaconta-2(15),3,6,8,10,13,17(30),18,21,23,25,28,31,33,35,37,39,41,45,47,49,51,53,55-tetracosaene	103960-17-4	C₅₆H₃₆	708.902

反应信息

作为反应物：

描述：

57-oxahexadecacyclo[14.14.14.620,27.634,41.15,12.02,15.04,13.06,11.017,30.019,28.021,26.031,44.033,42.035,40.045,50.051,56]heptapentaconta-2(15),6,8,10,17(30),18,21,23,25,28,31(44),32,35,37,39,42,45,47,49,51,53,55-docosaene 在盐酸作用下，以乙酸酐为溶剂，反应 20.0h，以63%的产率得到pentadecacyclo[14.14.14.65,12.620,27.02,15.04,13.06,11.017,30.019,28.021,26.031,44.033,42.035,40.045,50.051,56]hexapentaconta-2(15),3,6,8,10,13,17(30),18,21,23,25,28,31,33,35,37,39,41,45,47,49,51,53,55-tetracosaene

参考文献：

名称：

Tritriptycene: a D3h C62 hydrocarbon with three U-shaped cavities

摘要：

DOI：

10.1021/ja00281a038
作为产物：

描述：

1,4-二氢-1,4-环氧萘、 37,38-dimethylidenedodecacyclo[22.6.6.69,16.25,20.02,23.04,21.06,19.08,17.010,15.025,30.031,36.039,44]tetratetraconta-2,4(21),6(19),7,10,12,14,17,22,25,27,29,31,33,35,39,41,43-octadecaene 以 xylene 为溶剂，反应 48.0h，以71%的产率得到57-oxahexadecacyclo[14.14.14.620,27.634,41.15,12.02,15.04,13.06,11.017,30.019,28.021,26.031,44.033,42.035,40.045,50.051,56]heptapentaconta-2(15),6,8,10,17(30),18,21,23,25,28,31(44),32,35,37,39,42,45,47,49,51,53,55-docosaene

参考文献：

名称：

Tritriptycene: a D3h C62 hydrocarbon with three U-shaped cavities

摘要：

DOI：

10.1021/ja00281a038

点击查看最新优质反应信息

文献信息

BASHIR-HASHEMI ABDOLLAH; HART H.; WARD D. L., J. AMER. CHEM. SOC., 108,(1986) N 21, 6675-6679

作者：BASHIR-HASHEMI ABDOLLAH、 HART H.、 WARD D. L.

DOI：——

日期：——

同类化合物

（S）-（+）-5,5''，6,6''，7,7''，8,8''-八氢-3,3''-二叔丁基-1,1''-二-2-萘酚，双钾盐顺式-4-(4-氯苯基)-1,2,3,4-四氢-N-甲基-1-萘胺盐酸盐顺式-4-(3,4-二氯苯基)-1,2,3,4-四氢N-叔丁氧羰基-1-萘胺顺式-1-苯甲酰氧基-2-二甲基氨基-1,2,3,4-四氢萘顺式-1,2,3,4-四氢-5-环氧丙氧基-2,3-萘二醇顺式-(1S,4S)-N-甲基-4-(3,4-二氯苯基)-1,2,3,4-四氢-1-萘胺扁桃酸盐顺-5,6,7,8-四氢-6,7-二羟基-1-萘酚顺-(+)-5-甲氧基-1-甲基-2-(二正丙基氨基)萘满马来酸阿洛米酮阿戈美拉汀杂质醇(A) 阿戈美拉汀杂质钠2-羟基-7-甲氧基-1,2,3,4-四氢-2-萘磺酸酯金钟醇邻烯丙基苯基溴化镁那高利特盐酸盐那高利特过氧化,1,1-二甲基乙基1,2,3,4-四氢-1-萘基贝多拉君螺<4.7>十二烷蔡醇酮萘磺酸,二癸基-1,2,3,4-四氢- 萘并[2,3-d]噁唑-2,5-二酮,3,6,7,8-四氢-3-甲基- 萘并[2,3-d]咪唑,2-乙基-5,6,7,8-四氢-(6CI) 萘亚胺苯甲酸-(5,6,7,8-四氢-[2]萘基酯) 苯甲丁氮酮苯甲丁氮酮苯甲丁氮酮苯并烯氟菌唑苄基[(2S)-7-羟基-1,2,3,4-四氢萘-2-基]氨基甲酸酯苄基-5-甲氧基-1,2,3,4-四氢萘-2-基氨基甲酸酯苄基(1,2,3,4-四氢萘-2-基)胺舍曲林二甲基杂质盐酸盐舍曲林EP杂质B 舍曲林2,3-二氯亚胺杂质舍曲林羟甲基四氢萘酚羟基-苯基-(5,6,7,8-四氢-[2]萘基)-乙酸美曲唑啉罗替戈汀硫酸盐罗替戈汀杂质19 罗替戈汀杂质18 罗替戈汀杂质11 罗替戈汀中间体罗替戈汀中间体罗替戈汀罗替戈汀纳多洛尔杂质米贝地尔(二盐酸盐) 硅烷,[3-(3,4-二氢-1(2H)-萘亚基)-1-炔丙基]三甲基-,(Z)-