86307-22-4 ((Butanoic acid, 3-[7-(1,5-dimethylhexyl)-2,3,4a,6,6a,7,8,9,9a,11-decahydro-6a-methyl-1,3-dioxo-2-phenyl-1H,5H-cyclopenta[f][1,2,4]triazolo[1,2-a]cinnolin-11-yl]-4-methyl-3-cyclohexen-1-yl ester, [4aR-[4aα,6aα,7α(R),9aβ,11α(S)]]- (9CI))

结构式：

Butanoic acid, 3-[7-(1,5-dimethylhexyl)-2,3,4a,6,6a,7,8,9,9a,11-decahydro-6a-methyl-1,3-dioxo-2-phenyl-1H,5H-cyclopenta[f][1,2,4]triazolo[1,2-a]cinnolin-11-yl]-4-methyl-3-cyclohexen-1-yl ester, [4aR-[4aα,6aα,7α(R*),9aβ,11α(S*)]]- (9CI)MOL文件

CAS号：

86307-22-4

英文名称：

分子式：

C₃₉H₅₅N₃O₄

分子量：

629.871711015701

Butanoic acid, 3-[7-(1,5-dimethylhexyl)-2,3,4a,6,6a,7,8,9,9a,11-decahydro-6a-methyl-1,3-dioxo-2-phenyl-1H,5H-cyclopenta[f][1,2,4]triazolo[1,2-a]cinnolin-11-yl]-4-methyl-3-cyclohexen-1-yl ester, [4aR-[4aα,6aα,7α(R),9aβ,11α(S)]]- (9CI)(86307-22-4)名称与标识符

名称

英文别名：

标识符

InChIKey：

YIBUGBOEEZELHY-BSOSFTJXSA-N

Inchi：

1S/C39H55N3O4/c1-7-12-36(43)46-29-18-17-26(4)30(23-29)35-24-31-33-20-19-32(27(5)14-11-13-25(2)3)39(33,6)22-21-34(31)41-37(44)40(38(45)42(35)41)28-15-9-8-10-16-28/h8-10,15-16,24-25,27,29,32-35H,7,11-14,17-23H2,1-6H3/t27?,29?,32-,33+,34-,35+,39-/m0/s1

SMILES：

C(OC1CCC(C)=C([C@H]2C=C3[C@@]([H])(N4C(=O)N(C5=CC=CC=C5)C(=O)N42)CC[C@@]2(C)[C@H](C(C)CCCC(C)C)CC[C@]32[H])C1)(=O)CCC

Butanoic acid, 3-[7-(1,5-dimethylhexyl)-2,3,4a,6,6a,7,8,9,9a,11-decahydro-6a-methyl-1,3-dioxo-2-phenyl-1H,5H-cyclopenta[f][1,2,4]triazolo[1,2-a]cinnolin-11-yl]-4-methyl-3-cyclohexen-1-yl ester, [4aR-[4aα,6aα,7α(R),9aβ,11α(S)]]- (9CI)(86307-22-4)物化性质

实验特性

沸点 : 672.5±65.0 °C(Predicted)
酸度系数(pKa) : -0.49±0.70(Predicted)
密度 : 1.17±0.1 g/cm3(Predicted)

81059-04-3(3-[(2-tert-butyl-5-methoxy-1,3-benzothiazol-6-yl)carbamothioylsulfanyl]propanoic acid) 81882-18-0(1-benzofuran-2-ylmethanamine;hydrochloride) 81720-06-1([(1aS,1bα,5aα,6aβ)-2α-(β-D-Glucopyranosyloxy)-1a,1b,2,5a,6,6a-hexahydro-1aβ-(hydroxymethyl)oxireno[4,5]cyclopenta[1,2-c]pyran-6α-yl]α-D-galactopyranoside) 81840-57-5(（1E）-1-（4-羟基-3-甲氧基苯基）-7-苯基庚-1-烯-3-酮) 819058-89-4(4-(4-氨基苯基)-1H-吲唑-3-胺) 81964-65-0(1-乙酰基-5-溴-1H-吲哚-2,3-二酮) 819-52-3(氯磺酸正丙酯) 81998-03-0(4,4'-二甲基-2,2'-联吡啶1-氧化物)

960化工网为您提供Butanoic acid, 3-[7-(1,5-dimethylhexyl)-2,3,4a,6,6a,7,8,9,9a,11-decahydro-6a-methyl-1,3-dioxo-2-phenyl-1H,5H-cyclopenta[f][1,2,4]triazolo[1,2-a]cinnolin-11-yl]-4-methyl-3-cyclohexen-1-yl ester, [4aR-[4aα,6aα,7α(R*),9aβ,11α(S*)]]- (9CI)专业化合物百科信息，包括中文名，英文名，分子式，分子量，以及该化合物的CasNo.86307-22-4,相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等。 WAP版:86307-22-4 国际站:86307-22-4

86307-22-4 ((Butanoic acid, 3-[7-(1,5-dimethylhexyl)-2,3,4a,6,6a,7,8,9,9a,11-decahydro-6a-methyl-1,3-dioxo-2-phenyl-1H,5H-cyclopenta[f][1,2,4]triazolo[1,2-a]cinnolin-11-yl]-4-methyl-3-cyclohexen-1-yl ester, [4aR-[4aα,6aα,7α(R*),9aβ,11α(S*)]]- (9CI))

Butanoic acid, 3-[7-(1,5-dimethylhexyl)-2,3,4a,6,6a,7,8,9,9a,11-decahydro-6a-methyl-1,3-dioxo-2-phenyl-1H,5H-cyclopenta[f][1,2,4]triazolo[1,2-a]cinnolin-11-yl]-4-methyl-3-cyclohexen-1-yl ester, [4aR-[4aα,6aα,7α(R*),9aβ,11α(S*)]]- (9CI)(86307-22-4)名称与标识符

名称

标识符

Butanoic acid, 3-[7-(1,5-dimethylhexyl)-2,3,4a,6,6a,7,8,9,9a,11-decahydro-6a-methyl-1,3-dioxo-2-phenyl-1H,5H-cyclopenta[f][1,2,4]triazolo[1,2-a]cinnolin-11-yl]-4-methyl-3-cyclohexen-1-yl ester, [4aR-[4aα,6aα,7α(R*),9aβ,11α(S*)]]- (9CI)(86307-22-4)物化性质

实验特性

目录

86307-22-4 ((Butanoic acid, 3-[7-(1,5-dimethylhexyl)-2,3,4a,6,6a,7,8,9,9a,11-decahydro-6a-methyl-1,3-dioxo-2-phenyl-1H,5H-cyclopenta[f][1,2,4]triazolo[1,2-a]cinnolin-11-yl]-4-methyl-3-cyclohexen-1-yl ester, [4aR-[4aα,6aα,7α(R),9aβ,11α(S)]]- (9CI))

Butanoic acid, 3-[7-(1,5-dimethylhexyl)-2,3,4a,6,6a,7,8,9,9a,11-decahydro-6a-methyl-1,3-dioxo-2-phenyl-1H,5H-cyclopenta[f][1,2,4]triazolo[1,2-a]cinnolin-11-yl]-4-methyl-3-cyclohexen-1-yl ester, [4aR-[4aα,6aα,7α(R),9aβ,11α(S)]]- (9CI)(86307-22-4)名称与标识符

Butanoic acid, 3-[7-(1,5-dimethylhexyl)-2,3,4a,6,6a,7,8,9,9a,11-decahydro-6a-methyl-1,3-dioxo-2-phenyl-1H,5H-cyclopenta[f][1,2,4]triazolo[1,2-a]cinnolin-11-yl]-4-methyl-3-cyclohexen-1-yl ester, [4aR-[4aα,6aα,7α(R),9aβ,11α(S)]]- (9CI)(86307-22-4)物化性质