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2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

更新时间:2026-07-01 18:09:08

2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate结构式
2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate结构式
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常用名 2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate 英文名 2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
CAS号 6998-17-0 分子量 718.86000
密度 1.25g/cm3 沸点 816.2ºC at 760 mmHg
分子式 C41H42N4O6S 熔点 N/A
MSDS N/A 闪点 447.4ºC

 名称

本表展示该化学物质的中文名称、英文系统名、各类中文与英文别名信息。

英文名 2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
英文别名 更多

 物理化学性质

本表包含该物质理化参数,如熔点、沸点、密度、溶解度、旋光性等理化指标,无数据项标记为N/A。

密度 1.25g/cm3
沸点 816.2ºC at 760 mmHg
分子式 C41H42N4O6S
分子量 718.86000
闪点 447.4ºC
精确质量 718.28300
PSA 142.25000
LogP 5.93420
InChIKey UVMMNISTPSPBDR-UHFFFAOYSA-N
SMILES COC(=O)c1ccc(C2C(C(=O)OCC(C)C)=C(C)N=c3sc(=Cc4cn(-c5ccccc5)nc4-c4ccc(OCCC(C)C)cc4)c(=O)n32)cc1
折射率 1.631

 合成线路

本表提供该化合物公开报道的合成路线、反应条件、反应物与产物参考信息。

~9%

2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate结构式

2-methylpropyl ...

6998-17-0

查看详情
文献:Butler, Richard N.; Morris, Gerard J. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1980 , p. 2218 - 2221

~%

2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate结构式

2-methylpropyl ...

6998-17-0

查看详情
文献:Butler, Richard N.; Morris, Gerard J. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1980 , p. 2218 - 2221

~%

2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate结构式

2-methylpropyl ...

6998-17-0

查看详情
文献:v. Auwers Chemische Berichte, 1917 , vol. 50, p. 1180

~%

2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate结构式

2-methylpropyl ...

6998-17-0

查看详情
文献:Neuberg; Hirsch Biochemische Zeitschrift, 1921 , vol. 115, p. 304

~%

2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate结构式

2-methylpropyl ...

6998-17-0

查看详情
文献:v. Auwers Chemische Berichte, 1917 , vol. 50, p. 1180

~%

2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate结构式

2-methylpropyl ...

6998-17-0

查看详情
文献:v. Auwers Chemische Berichte, 1917 , vol. 50, p. 1180

~%

2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate结构式

2-methylpropyl ...

6998-17-0

查看详情
文献:Fusco,R. et al. Chemische Berichte, 1963 , vol. 96, p. 802 - 812

~%

2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate结构式

2-methylpropyl ...

6998-17-0

查看详情
文献:Fusco,R. et al. Chemische Berichte, 1963 , vol. 96, p. 802 - 812

~%

2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate结构式

2-methylpropyl ...

6998-17-0

查看详情
文献:Butler, Richard N.; Morris, Gerard J. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1980 , p. 2218 - 2221

 英文别名

本表罗列该化合物全部英文别名、系统命名、CAS别名等英文名称集合。

1-phenyl-propane-1,2-dione-bis-(4-nitro-phenylhydrazone)
Methylphenylglyoxal-bis-(4-nitro-phenylhydrazon)
1-Phenyl-propan-1,2-dion-bis-(4-nitro-phenylhydrazon)
bis(p-nitrophenylhydrazon)-1-phenylpropandione
Methylphenylglyoxal-(4-nitro-phenylosazon)

 常见问题

本部分为该化合物相关常见问答,包含基础参数、性状、储存条件等高频咨询问题与对应答案。

Q: 6998-17-0的InChIKey是什么?
A: 6998-17-0InChIKey为UVMMNISTPSPBDR-UHFFFAOYSA-N。
Q: 6998-17-0有哪些英文别名?
A: 6998-17-0英文别名有:1-phenyl-propane-1,2-dione-bis-(4-nitro-phenylhydrazone)、 Methylphenylglyoxal-bis-(4-nitro-phenylhydrazon)、 1-Phenyl-propan-1,2-dion-bis-(4-nitro-phenylhydrazon)、 bis(p-nitrophenylhydrazon)-1-phenylpropandione、 Methylphenylglyoxal-(4-nitro-phenylosazon)。
Q: 6998-17-0的分子量是多少?
A: 6998-17-0分子量为718.86000。
Q: 6998-17-0的分子式是什么?
A: 6998-17-0分子式为C41H42N4O6S。
Q: 6998-17-0的中文名称是什么?
A: 6998-17-0的中文名称为6998-17-0。
Q: 6998-17-0的CAS号是多少?
A: 6998-17-0CAS号为6998-17-0。
Q: 6998-17-0的上游原料有哪些?
A: 6998-17-0相关上游原料(CAS):74327-12-1;636-99-7;100-16-3;71-43-2;2114-00-3;100-61-8;76312-32-8;75815-88-2。
Q: 6998-17-0的沸点是多少?
A: 6998-17-0沸点为816.2ºC at 760 mmHg。
Q: 6998-17-0的英文名称是什么?
A: 6998-17-0英文名称为2-methylpropyl 5-(4-methoxycarbonylphenyl)-7-methyl-2-[[3-[4-(3-methylbutoxy)phenyl]-1-phenylpyrazol-4-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate。
Q: 6998-17-0的SMILES表达式是什么?
A: 6998-17-0SMILES表达式为COC(=O)c1ccc(C2C(C(=O)OCC(C)C)=C(C)N=c3sc(=Cc4cn(-c5ccccc5)nc4-c4ccc(OCCC(C)C)cc4)c(=O)n32)cc1。
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