2-[2-[[5-亚氨基-3-甲基-1-(8-磺酸根-2-萘基)-4H-吡唑-4-基]偶氮]-5-[4-[[5-亚氨基-3-甲基-1-(8-磺酸根-2-萘基)-4H-吡唑-4-基]偶氮]-3-(2-羟基-2-羰基-乙氧基)苯基]苯氧基]乙酸四钠 | 222631-09-6

分子结构分类

有机化合物 - 有机杂环化合物 - 吡咯烷类

中文名称

2-[2-[[5-亚氨基-3-甲基-1-(8-磺酸根-2-萘基)-4H-吡唑-4-基]偶氮]-5-[4-[[5-亚氨基-3-甲基-1-(8-磺酸根-2-萘基)-4H-吡唑-4-基]偶氮]-3-(2-羟基-2-羰基-乙氧基)苯基]苯氧基]乙酸四钠

中文别名

——

英文名称

N-tert-butoxycarbonyl-7-O-tert-butyldimethylsilyl-2,3,6-trideoxy-3,6-imino-4,5-O-isopropylidene-D-allo-heptononitrile

英文别名

(3aR,4R,6S,6aS)-tert-butyl 4-(((tert-butyldimethylsilyl)oxy)methyl)-6-(cyanomethyl)-2,2-dimethyldihydro-3aH-[1,3]dioxolo[4,5-c]pyrrole-5(4H)-carboxylate；tert-butyl (3aR,4R,6S,6aS)-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-(cyanomethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate

2-[2-[[5-亚氨基-3-甲基-1-(8-磺酸根-2-萘基)-4H-吡唑-4-基]偶氮]-5-[4-[[5-亚氨基-3-甲基-1-(8-磺酸根-2-萘基)-4H-吡唑-4-基]偶氮]-3-(2-羟基-2-羰基-乙氧基)苯基]苯氧基]乙酸四钠化学式

CAS

222631-09-6

化学式

C₂₁H₃₈N₂O₅Si

mdl

——

分子量

426.629

InChiKey

IVDCKBIFTAMOED-VVLHAWIVSA-N

BEILSTEIN

——

EINECS

——

物化性质

沸点：

496.3±40.0 °C(Predicted)
密度：

1.028±0.06 g/cm3(Predicted)

计算性质

辛醇/水分配系数(LogP)：

4.43
重原子数：

29
可旋转键数：

7
环数：

2.0
sp3杂化的碳原子比例：

0.9
拓扑面积：

81
氢给体数：

0
氢受体数：

6

SDS

SDS：ca08a00dc73a9875cb1655ba4874f3f7

查看

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
1H-咪唑并[1,2-b]吡唑-2-醇,7-氨基-6-甲基-	7-O-tert-butyldimethylsilyl-2,3,6-trideoxy-3,6-imino-4,5-O-isopropylidene-D-allo-heptononitrile	222631-08-5	C₁₆H₃₀N₂O₃Si	326.511
——	2-((3aS,6R,6aR)-6-(((tert-butyldimethylsilyl)oxy)methyl)-5-hydroxy-2,2-dimethyltetrahydro-3aH-[1,3]dioxolo[4,5-c]pyrrol-4-yl)acetonitrile	1610426-21-5	C₁₆H₃₀N₂O₄Si	342.511
(3AR,4R,6AS)-5-苄基-4-(((叔丁基二甲基硅烷基)氧基)甲基)-2,2-二甲基四	5-O-tert-butyldimethylsilyl-1,4-N-benzylimino-2,3-O-isopropylidene-D-ribitol	153172-30-6	C₂₁H₃₅NO₃Si	377.599
(3AR,4R,6AS)-4-[[[(叔丁酯)二甲基硅烷基]氧基]甲基]四氢-2,2-二甲基-4H-1,3-二氧杂环戊烯并[4,5-C]吡咯	5-O-tert-butyldimethylsilyl-1,4-dideoxy-1,4-imino-2,3-O-isopropylidene-D-ribitol	153172-31-7	C₁₄H₂₉NO₃Si	287.475

下游产品

中文名称	英文名称	CAS号	化学式	分子量
——	tert-butyl (3aR,4R,6S,6aS)-6-(2-aminoethyl)-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,2-dimethyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	1020107-31-6	C₂₁H₄₂N₂O₅Si	430.66
1-氮杂二环[2.2.1]庚烷,3-(氨基氧代)-,内-(9CI)	N-tert-butoxycarbonyl-3,6-imino-4,5-O-isopropylidene-2,3,6-trideoxy-D-allo-heptononitrile	222631-50-7	C₁₅H₂₄N₂O₅	312.366
——	tert-butyl (3aR,4R,6S,6aS)-6-(cyanomethyl)-4-(methoxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	712281-30-6	C₁₆H₂₆N₂O₅	326.393
——	N-tert-butoxycarbonyl-3,6-imino-4,5-O-isopropylidene-2,3,6,7-tetradeoxy-D-allo-heptononitrile	607389-20-8	C₁₅H₂₄N₂O₄	296.367
——	tert-butyl (3aS,4S,6R,6aR)-4-(cyanomethyl)-2,2-dimethyl-6-propyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	607389-42-4	C₁₇H₂₈N₂O₄	324.42
4-氨基-3,6-二[[4-[(2,4-二氨基苯基)偶氮]苯基]偶氮]-5-羟基萘-2,7-二磺基酸,盐锂钠	(3aR,4R,6S,6aS)-tert-butyl 4-(((tert-butyldimethylsilyl)oxy)methyl)-6-((E/Z)-1-cyano-2-hydroxyvinyl)-2,2-dimethyldihydro-3aH-[1,3]dioxolo[4,5-c]pyrrole-5(4H)-carboxylate	222631-10-9	C₂₂H₃₈N₂O₆Si	454.639
——	(1S)-N-tert-butoxycarbonyl-5-O-tert-butyldimethylsilyl-1-C-(1-cyano-2-hydroxyethenyl)-1,4-dideoxy-1,4-imino-2,3-O-isopropylidene-D-ribitol	284490-14-8	C₂₂H₃₈N₂O₆Si	454.639
2-氯-N-(2,3-二甲基苯基)-N-(丙烷-2-基)乙酰胺	(3aR,4R,6S,6aS)-4-(tert-Butyl-dimethyl-silanyloxymethyl)-6-[(Z)-1-cyano-2-(cyanomethyl-amino)-vinyl]-2,2-dimethyl-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylic acid tert-butyl ester	222631-45-0	C₂₄H₄₀N₄O₅Si	492.691
——	N-tert-butoxycarbonyl-3,6-imino-4,5-O-isopropylidene-7-O-methanesulfonyl-2,3,6-trideoxy-D-allo-heptononitrile	607389-13-9	C₁₆H₂₆N₂O₇S	390.458
噻吩并[2,3-b]吡啶,2,3-二氢-6-甲基-4-苯基-	N-tert-butoxycarbonyl-7-O-tert-butyldimethylsilyl-2-cyano-1,2,3,6-tetradeoxy-1-N-(ethoxycarbonylmethylamino)-3,6-imino-4,5-O-isopropylidene-D-allo-hept-1-enitol	222631-11-0	C₂₆H₄₅N₃O₇Si	539.745
4-(2-溴乙基)-2-苯基吗啉-2-醇	N-tert-butoxycarbonyl-2,3,6,7-tetradeoxy-7-fluoro-3,6-imino-4,5-O-isopropylidene-D-allo-heptononitrile	222631-90-5	C₁₅H₂₃FN₂O₄	314.357
——	tert-butyl (3aR,4S,6S,6aS)-6-(cyanomethyl)-4-(ethylsulfanylmethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	607389-28-6	C₁₇H₂₈N₂O₄S	356.486
——	tert-butyl (3aR,4S,6S,6aS)-6-(cyanomethyl)-2,2-dimethyl-4-(propylsulfanylmethyl)-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	712281-31-7	C₁₈H₃₀N₂O₄S	370.513
——	tert-butyl (3aR,4S,6S,6aS)-6-(cyanomethyl)-4-(2-fluoroethylsulfanylmethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	712281-41-9	C₁₇H₂₇FN₂O₄S	374.477
——	tert-butyl (3aR,4S,6S,6aS)-6-(cyanomethyl)-4-(2-hydroxyethylsulfanylmethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	712281-32-8	C₁₇H₂₈N₂O₅S	372.486
——	tert-butyl (3aR,4S,6S,6aS)-6-(cyanomethyl)-2,2-dimethyl-4-(phenylsulfanylmethyl)-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	712281-33-9	C₂₁H₂₈N₂O₄S	404.53
——	tert-butyl (3aR,4S,6S,6aS)-4-(benzylsulfanylmethyl)-6-(cyanomethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	712281-39-5	C₂₂H₃₀N₂O₄S	418.557
——	tert-butyl (3aR,4S,6S,6aS)-6-(cyanomethyl)-4-[(4-fluorophenyl)sulfanylmethyl]-2,2-dimethyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	712281-34-0	C₂₁H₂₇FN₂O₄S	422.521
——	tert-butyl (3aR,4S,6S,6aS)-6-(cyanomethyl)-2,2-dimethyl-4-[(4-methylphenyl)sulfanylmethyl]-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	712281-36-2	C₂₂H₃₀N₂O₄S	418.557
——	tert-butyl (3aR,4S,6S,6aS)-4-[(4-chlorophenyl)sulfanylmethyl]-6-(cyanomethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	712281-35-1	C₂₁H₂₇ClN₂O₄S	438.975
——	tert-butyl (3aR,4S,6S,6aS)-6-(cyanomethyl)-2,2-dimethyl-4-[(3-methylphenyl)sulfanylmethyl]-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	712281-38-4	C₂₂H₃₀N₂O₄S	418.557
——	tert-butyl (3aR,4S,6S,6aS)-4-[(3-chlorophenyl)sulfanylmethyl]-6-(cyanomethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	712281-37-3	C₂₁H₂₇ClN₂O₄S	438.975
——	tert-butyl (3aR,4S,6S,6aS)-6-(cyanomethyl)-2,2-dimethyl-4-(naphthalen-1-ylsulfanylmethyl)-3a,4,6,6a-tetrahydro-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate	712281-