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2-[(5-methyl-2-furyl)methylidene]propanedinitrile

更新时间:2025-08-20 22:18:03

2-[(5-methyl-2-furyl)methylidene]propanedinitrile结构式
2-[(5-methyl-2-furyl)methylidene]propanedinitrile结构式
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常用名 2-[(5-methyl-2-furyl)methylidene]propanedinitrile 英文名 2-[(5-methyl-2-furyl)methylidene]propanedinitrile
CAS号 81020-79-3 分子量 158.15700
密度 1.193g/cm3 沸点 275ºC at 760mmHg
分子式 C9H6N2O 熔点 N/A
MSDS N/A 闪点 120.1ºC

 名称

英文名 2-[(5-methylfuran-2-yl)methylidene]propanedinitrile
英文别名 更多

 物理化学性质

密度 1.193g/cm3
沸点 275ºC at 760mmHg
分子式 C9H6N2O
分子量 158.15700
闪点 120.1ºC
精确质量 158.04800
PSA 60.72000
LogP 2.01856
InChIKey LYDFGOIVNORMMX-UHFFFAOYSA-N
SMILES Cc1ccc(C=C(C#N)C#N)o1

 合成线路

~45%

2-[(5-methyl-2-furyl)methylidene]propanedinitrile结构式

2-[(5-methyl-2-...

81020-79-3

文献:Mantri, Monica; De Graaf, Olivier; Van Veldhoven, Jacobus; Goeblyoes, Aniko; Von Frijtag Drabbe Kuenzel, Jacobien K.; Mulder-Krieger, Thea; Link, Regina; De Vries, Henk; Beukers, Margot W.; Brussee, Johannes; Ijzerman, Adriaan P. Journal of Medicinal Chemistry, 2008 , vol. 51, # 15 p. 4449 - 4455

~57%

2-[(5-methyl-2-furyl)methylidene]propanedinitrile结构式

2-[(5-methyl-2-...

81020-79-3

文献:Marchalin, Stefan; Ilavsky, Dusan; Kovac, Jaroslav; Bruncko, Milan Collection of Czechoslovak Chemical Communications, 1990 , vol. 55, # 3 p. 718 - 727

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 靶点实验

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实验名称:Cell survival assay for modulators of telomere damage signalling
来源:15378
靶标:N/A
External Id:TELO_02
实验名称:Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:HCMV UL50
External Id:HMS1262
实验名称:Chemical Probes of Kaposi's Sarcoma Herpes Virus Latent Infection
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:ORF 73 [Human herpesvirus 8 type M]
External Id:HMS791
实验名称:NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
来源:DTP/NCI
靶标:N/A
External Id:MCF7_OneDose
实验名称:NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
来源:DTP/NCI
靶标:N/A
External Id:IGROV1_OneDose
实验名称:High-throughput screen for inhibitors of the GIV GBA-motif interaction with Galpha-i ...
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id:HMS1303
实验名称:A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id:HMS979
实验名称:Alphascreen assay for small molecules abrogating mHTT-CaM Interaction
来源:24983
靶标:Huntingtin
External Id:KUHTS-Muma KU-CaM-Htt INH-01
实验名称:A screen for compounds that inhibit viral RNA polymerase binding and polymerization a...
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:Chain A, Poliovirus Polymerase With Gtp
External Id:HMS750
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 英文别名

2-(5-methyl-2-furanyl)methylidene-propanedinitrile
[(5-methylfuran-2-yl)methylidene]propanedinitrile
HMS1667D16
2-((5-methylfuran-2-yl)methylene)malononitrile
5-methyl-2-furylmethylenepropanedinitrile
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