methyl 6-chloro-5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-1H-indole-3-carboxylate | 1467060-68-9

分子结构分类

有机化合物 - 有机杂环化合物 - 吲哚及其衍生物

中文名称

——

中文别名

——

英文名称

methyl 6-chloro-5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-1H-indole-3-carboxylate

英文别名

——

methyl 6-chloro-5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-1H-indole-3-carboxylate化学式

CAS

1467060-68-9

化学式

C₁₅H₁₇BClNO₄

mdl

——

分子量

321.568

InChiKey

PTICAZXUYAIOSL-UHFFFAOYSA-N

BEILSTEIN

——

EINECS

——

物化性质

沸点：

498.1±45.0 °C(Predicted)
密度：

1.29±0.1 g/cm3(Predicted)

计算性质

辛醇/水分配系数(LogP)：

2.38
重原子数：

22
可旋转键数：

3
环数：

3.0
sp3杂化的碳原子比例：

0.4
拓扑面积：

60.6
氢给体数：

1
氢受体数：

4

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
5-溴-6-氯-1H-吲哚-3-羧酸甲酯	methyl 5-bromo-6-chloro-1H-indole-3-carboxylate	1467059-91-1	C₁₀H₇BrClNO₂	288.528

下游产品

中文名称	英文名称	CAS号	化学式	分子量
——	methyl 6-chloro-5-(4-methylphenyl)-1H-indole-3-carboxylate	1467060-85-0	C₁₇H₁₄ClNO₂	299.757
——	methyl 6-chloro-5-{4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl}-1H-indole-3-carboxylate	1467060-88-3	C₂₄H₂₈ClN₃O₃	441.958
——	methyl 6-chloro-5-{4-[3-(piperazin-1-yl)propoxy]phenyl}-1H-indole-3-carboxylate	1467060-87-2	C₂₃H₂₆ClN₃O₃	427.931
——	methyl 6-chloro-5-{4-[2-(piperazin-1-yl)ethoxy]phenyl}-1H-indole-3-carboxylate	1467060-83-8	C₂₂H₂₄ClN₃O₃	413.904
——	methyl 6-chloro-5-{4-[3-(morpholin-4-yl)propoxy]phenyl}-1H-indole-3-carboxylate	1467060-71-4	C₂₃H₂₅ClN₂O₄	428.915
——	methyl 6-chloro-5-(3,4-dimethoxyphenyl)-1H-indole-3-carboxylate	1467060-69-0	C₁₈H₁₆ClNO₄	345.782
——	methyl 5-(4-azetidin-2-ylphenyl)-6-chloro-1H-indole-3-carboxylate	1467061-05-7	C₁₉H₁₇ClN₂O₂	340.809
——	methyl 6-chloro-5-{4-[(2S)-pyrrolidin-2-ylmethoxy]phenyl}-1H-indole-3-carboxylate	1467060-82-7	C₂₁H₂₁ClN₂O₃	384.862
——	methyl 6-chloro-5-[4-(3-hydroxypropoxy)-3-methoxyphenyl]-1H-indole-3-carboxylate	1467060-98-5	C₂₀H₂₀ClNO₅	389.835
——	methyl 6-chloro-5-[4-(3-hydroxymethyloxetan-3-yl)phenyl]-1H-indole-3-carboxylate	1467061-51-3	C₂₀H₁₈ClNO₄	371.82
——	methyl 5-[4-(3-benzyloxymethyloxetan-3-yl)phenyl]-6-chloro-1H-indole-3-carboxylate	1467061-50-2	C₂₇H₂₄ClNO₄	461.945
——	methyl 6-chloro-5-{4-[3-(3-oxomorpholin-4-yl)propoxy]phenyl}-1H-indole-3-carboxylate	1467060-90-7	C₂₃H₂₃ClN₂O₅	442.899
——	methyl 6-chloro-5-[3-fluoro-4-(3-hydroxypropoxy)phenyl]-1H-indole-3-carboxylate	1467060-97-4	C₁₉H₁₇ClFNO₄	377.8
——	methyl 6-chloro-5-(4-(2-hydroxypropan-2-yl)-3-methoxyphenyl)-1H-indole-3-carboxylate	1467060-95-2	C₂₀H₂₀ClNO₄	373.836
——	methyl 5-[4-(1-acetylpiperidin-4-yl)phenyl]-6-chloro-1H-indole-3-carboxylate	1467061-07-9	C₂₃H₂₃ClN₂O₃	410.9
——	methyl 6-chloro-5-[4-(2-oxopyrrolidin-1-yl)phenyl]-1H-indole-3-carboxylate	1467061-06-8	C₂₀H₁₇ClN₂O₃	368.82
——	methyl 6-chloro-5-(4-(1-hydroxy-2-methylpropan-2-yl)-3-methoxyphenyl)-1H-indole-3-carboxylate	1467061-10-4	C₂₁H₂₂ClNO₄	387.863
——	methyl 6-chloro-5-(2,3-dihydrobenzofuran-6-yl)-1H-indole-3-carboxylate	1467060-96-3	C₁₈H₁₄ClNO₃	327.767
——	6-chloro-5-(4-methylphenyl)-1H-indole-3-carboxylic acid	1467058-40-7	C₁₆H₁₂ClNO₂	285.73
——	6-chloro-5-{4-[2-(methylamino)-2-oxoethoxy]phenyl}-1H-indole-3-carboxylic acid	1467058-80-5	C₁₈H₁₅ClN₂O₄	358.781
——	6-chloro-5-{4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl}-1H-indole-3-carboxylic acid	1467058-43-0	C₂₃H₂₆ClN₃O₃	427.931
——	(+/-)-6-chloro-5-(4-{[trans-2-hydroxycyclopentyl]oxy}phenyl)-1H-indole-3-carboxylic acid	——	C₂₀H₁₈ClNO₄	371.82
——	6-chloro-5-{4-[3-(piperazin-1-yl)propoxy]phenyl}-1H-indole-3-carboxylic acid	1467058-41-8	C₂₂H₂₄ClN₃O₃	413.904
——	methyl 6-chloro-5-[4-(3-hydroxyoxetan-3-yl)-3-methoxyphenyl]-1H-indole-3-carboxylate	1467061-00-2	C₂₀H₁₈ClNO₅	387.82
——	methyl 5-[4-(1-acetylazetidin-2-yl)phenyl]-6-chloro-1H-indole-3-carboxylate	1467060-81-6	C₂₁H₁₉ClN₂O₃	382.846
——	6-chloro-5-{4-[2-(piperazin-1-yl)ethoxy]phenyl}-1H-indole-3-carboxylic acid	1467058-37-2	C₂₁H₂₂ClN₃O₃	399.877
——	5-(4-azetidin-2-ylphenyl)-6-chloro-1H-indole-3-carboxylic acid	1467058-59-8	C₁₈H₁₅ClN₂O₂	326.782
——	6-chloro-5-{4-[(2S)-pyrrolidin-2-ylmethoxy]phenyl}-1H-indole-3-carboxylic acid	1467058-36-1	C₂₀H₁₉ClN₂O₃	370.835
——	6-chloro-5-{4-[3-(hydroxymethyl)oxetan-3-yl]phenyl}-1H-indole-3-carboxylic acid	1467058-94-1	C₁₉H₁₆ClNO₄	357.793
——	6-chloro-5-(3,4-dimethoxyphenyl)-1H-indole-3-carboxylic acid	1467058-11-2	C₁₇H₁₄ClNO₄	331.755
——	6-chloro-5-[4-(3-hydroxypropoxy)-3-methoxyphenyl]-1H-indole-3-carboxylic acid	1467058-53-2	C₁₉H₁₈ClNO₅	375.809
——	methyl 6-chloro-5-{4-[1-(methylsulfonyl)azetidin-2-yl]phenyl}-1H-indole-3-carboxylate	1467060-79-2	C₂₀H₁₉ClN₂O₄S	418.901
——	6-chloro-5-(4-(2-hydroxypropan-2-yl)-3-methoxyphenyl)-1H-indole-3-carboxylic acid	1467058-48-5	C₁₉H₁₈ClNO₄	359.809
——	6-chloro-5-{4-[3-(3-oxomorpholin-4-yl)propoxy]phenyl}-1H-indole-3-carboxylic acid	1467058-44-1	C₂₂H₂₁ClN₂O₅	428.872
——	6-chloro-5-[3-fluoro-4-(3-hydroxypropoxy)phenyl]-1H-indole-3-carboxylic acid	1467058-51-0	C₁₈H₁₅ClFNO₄	363.773
——	5-[4-(1-acetylpiperidin-4-yl)phenyl]-6-chloro-1H-indole-3-carboxylic acid	1467058-63-4	C₂₂H₂₁ClN₂O₃	396.873
——	6-chloro-5-[4-(1-hydroxy-2-methylpropan-2-yl)-3-methoxyphenyl]-1H-indole-3-carboxylic acid	1467058-64-5	C₂₀H₂₀ClNO₄	373.836
——