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5-[(4-nitrophenoxy)methyl]-3-phenyl-4,5-dihydro-1,2-oxazole

更新时间:2026-07-08 11:53:23

5-[(4-nitrophenoxy)methyl]-3-phenyl-4,5-dihydro-1,2-oxazole结构式
5-[(4-nitrophenoxy)methyl]-3-phenyl-4,5-dihydro-1,2-oxazole结构式
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常用名 5-[(4-nitrophenoxy)methyl]-3-phenyl-4,5-dihydro-1,2-oxazole 英文名 5-[(4-nitrophenoxy)methyl]-3-phenyl-4,5-dihydro-1,2-oxazole
CAS号 93979-33-0 分子量 298.29300
密度 N/A 沸点 N/A
分子式 C16H14N2O4 熔点 N/A
MSDS N/A 闪点 N/A

 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 5-[(4-nitrophenoxy)methyl]-3-phenyl-4,5-dihydro-1,2-oxazole
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。

分子式 C16H14N2O4
分子量 298.29300
精确质量 298.09500
PSA 76.64000
LogP 3.12560
InChIKey HWSCRCWCJFWZQO-UHFFFAOYSA-N
SMILES O=[N+]([O-])c1ccc(OCC2CC(c3ccccc3)=NO2)cc1

 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。

~75%

5-[(4-nitrophenoxy)methyl]-3-phenyl-4,5-dihydro-1,2-oxazole结构式

5-[(4-nitrophen...

93979-33-0

查看详情
文献:Shimizu, Tomio; Hayashi, Yoshiyuki; Furukawa, Nobuhiro; Teramura, Kazuhiro Bulletin of the Chemical Society of Japan, 1991 , vol. 64, # 1 p. 318 - 320

~65%

5-[(4-nitrophenoxy)methyl]-3-phenyl-4,5-dihydro-1,2-oxazole结构式

5-[(4-nitrophen...

93979-33-0

查看详情
文献:Alksnis; Muravenko; Dirnens; Lukevics Chemistry of Heterocyclic Compounds, 2004 , vol. 40, # 6 p. 797 - 800

~%

5-[(4-nitrophenoxy)methyl]-3-phenyl-4,5-dihydro-1,2-oxazole结构式

5-[(4-nitrophen...

93979-33-0

查看详情
文献:Alksnis; Muravenko; Dirnens; Lukevics Chemistry of Heterocyclic Compounds, 2004 , vol. 40, # 6 p. 797 - 800

~72%

5-[(4-nitrophenoxy)methyl]-3-phenyl-4,5-dihydro-1,2-oxazole结构式

5-[(4-nitrophen...

93979-33-0

查看详情
文献:Shimizu, Tomio; Hayashi, Yoshiyuki; Shibafuchi, Hiroshi; Teramura, Kazuhiro Bulletin of the Chemical Society of Japan, 1986 , vol. 59, # 9 p. 2827 - 2832

 靶点实验

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本表记录该化合物靶点、体外体内实验、生物测定实验相关实验数据。

实验名称:Primary cell-based high-throughput screening assay for identification of compounds th...
来源:Johns Hopkins Ion Channel Center
靶标:regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id:JHICC_RGS_Act_HTS
实验名称:Luminescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id:OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
实验名称:QFRET-based biochemical primary high throughput screening assay to identify exosite i...
来源:The Scripps Research Institute Molecular Screening Center
靶标:disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id:ADAM17_INH_QFRET_1536_1X%INH PRUN
实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_AG_FLUO8_1536_1X%ACT PRUN
实验名称:uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
实验名称:High throughput fluorescence intensity-based biochemical assay to screen for small mo...
来源:University of Pittsburgh Molecular Library Screening Center
靶标:furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id:MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
实验名称:Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
来源:Broad Institute
靶标:FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id:2147-01_Inhibitor_SinglePoint_HTS_Activity
实验名称:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
来源:Broad Institute
靶标:N/A
External Id:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify pos...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
实验名称:Fluorescence polarization-based biochemical high throughput primary assay to identify...
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id:SIAE_INH_FP_1536_1X%INH PRUN
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 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。

Isoxazole,4,5-dihydro-5-[(4-nitrophenoxy)methyl]-3-phenyl
HMS2805M20
3-phenyl-5-(p-nitrophenoxymethyl)-2-isoxazoline

 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: 93979-33-0的英文名称是什么?
A: 93979-33-0英文名称为5-[(4-nitrophenoxy)methyl]-3-phenyl-4,5-dihydro-1,2-oxazole。
Q: 93979-33-0的分子式是什么?
A: 93979-33-0分子式为C16H14N2O4。
Q: 93979-33-0有哪些英文别名?
A: 93979-33-0英文别名有:Isoxazole,4,5-dihydro-5-[(4-nitrophenoxy)methyl]-3-phenyl、 HMS2805M20、 3-phenyl-5-(p-nitrophenoxymethyl)-2-isoxazoline。
Q: 93979-33-0的分子量是多少?
A: 93979-33-0分子量为298.29300。
Q: 93979-33-0的InChIKey是什么?
A: 93979-33-0InChIKey为HWSCRCWCJFWZQO-UHFFFAOYSA-N。
Q: 93979-33-0的SMILES表达式是什么?
A: 93979-33-0SMILES表达式为O=[N+]([O-])c1ccc(OCC2CC(c3ccccc3)=NO2)cc1。
Q: 93979-33-0的CAS号是多少?
A: 93979-33-0CAS号为93979-33-0。
Q: 93979-33-0的中文名称是什么?
A: 93979-33-0的中文名称为93979-33-0。
Q: 93979-33-0的极性表面积PSA是多少?
A: 93979-33-0极性表面积PSA为76.64000。
Q: 93979-33-0的LogP(油水分配系数)是多少?
A: 93979-33-0LogP(油水分配系数)为3.12560。
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