1,4-Naphthalenedione,2,3-dimethyl

• 常用名: 1,4-Naphthalenedione,2,3-dimethyl
• 英文名: 1,4-Naphthalenedione,2,3-dimethyl
• CAS号: 2197-57-1
• 分子量: 186.20700
• 密度: 1.174g/cm3
• 沸点: 312.5ºC at 760mmHg
• 分子式: C₁₂H₁₀O₂
• 熔点: N/A
• 闪点: 116.9ºC

1,4-Naphthalenedione,2,3-dimethyl名称

• 英文名: 2,3-dimethylnaphthalene-1,4-dione

1,4-Naphthalenedione,2,3-dimethyl物理化学性质

• 密度: 1.174g/cm3
• 沸点: 312.5ºC at 760mmHg
• 分子式: C₁₂H₁₀O₂
• 分子量: 186.20700
• 闪点: 116.9ºC
• 精确质量: 186.06800
• PSA: 34.14000
• LogP: 2.40200
• InChIKey: LGFDNUSAWCHVJN-UHFFFAOYSA-N
• SMILES: CC1=C(C)C(=O)c2ccccc2C1=O
• 蒸汽压: 0.000527mmHg at 25°C
• 折射率: 1.574
• 稳定性:

  1. 存在于烟叶中。

• 分子结构:

  1、 摩尔折射率：52.31

  2、 摩尔体积（cm³/mol）：158.5

  3、 等张比容（90.2K）：403.2

  4、 表面张力（dyne/cm）：41.8

  5、 极化率（10-24cm3）：20.73

• 计算化学:

  1.疏水参数计算参考值（XlogP）:无

  2.氢键供体数量:0

  3.氢键受体数量:2

  4.可旋转化学键数量:0

  5.互变异构体数量:3

  6.拓扑分子极性表面积34.1

  7.重原子数量:14

  8.表面电荷:0

  9.复杂度:293

  10.同位素原子数量:0

  11.确定原子立构中心数量:0

  12.不确定原子立构中心数量:0

  13.确定化学键立构中心数量:0

  14.不确定化学键立构中心数量:0

  15.共价键单元数量:1

• 更多:

  1. 熔点（ºC）：127

  2. 溶解性：溶于苯、乙酸乙酯。

1,4-Naphthalenedione,2,3-dimethyl毒性和生态

1,4-Naphthalenedione,2,3-dimethyl安全信息

• 海关编码: 2914690090

1,4-Naphthalenedione,2,3-dimethyl海关

• 海关编码: 2914690090
• 中文概述: 2914690090 其他醌. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:5.5% 普通关税:30.0%
• Summary: 2914690090 other quinones。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

1,4-Naphthalenedione,2,3-dimethyl靶点实验

查看更多实验

实验名称：Therapeutic index, ratio of cytotoxic TC50 for mouse HT22 cells to neuroprotective PD... 来源：ChEMBL 靶标：N/A External Id：CHEMBL2340249

实验名称：Neurotoxicity in mouse HT22 cells assessed as cell viability after 24 hrs by MTS assa... 来源：ChEMBL 靶标：HT-22 External Id：CHEMBL2340248

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：Neuroprotective activity in mouse HT22 cells assessed as prevention from glutamate-in... 来源：ChEMBL 靶标：HT-22 External Id：CHEMBL2340250

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：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

实验名称：Compound was evaluated for anticancer activity against Sarcoma180 tumor bearing mice ... 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL746667

实验名称：Compound was evaluated for anticancer activity against Sarcoma180 tumor bearing mice ... 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL878233

实验名称：Cytotoxicity against human THLE cells assessed as ATP depletion by CellTitre-Glo assa... 来源：ChEMBL 靶标：NON-PROTEIN TARGET External Id：CHEMBL3136231

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1,4-Naphthalenedione,2,3-dimethyl英文别名

• 2,3-dimethylnaphtho-1,4-quinone
• 2,3-Dimethyl-1,4-naphthoquinone
• USAF SN-29
• 1,4-Naphthalenedione,2,3-dimethyl
• 2,3-Dimethylnaphthoquinone
• 1,4-NAPHTHOQUINONE,2,3-DIMETHYL
• 2,3-dimethyl-1,4-dihydronaphthalene-1,4-dione