2-(甲基亚磺酰)苯酚

• 常用名: 2-(甲基亚磺酰)苯酚
• 英文名: 2-(Methylsulfinyl)phenol
• CAS号: 1074-02-8
• 分子量: 156.20200
• 密度: 1.36g/cm3
• 沸点: 327.9ºC at 760 mmHg
• 分子式: C₇H₈O₂S
• 熔点: 118-122ºC
• 闪点: 152.1ºC

2-(甲基亚磺酰)苯酚名称

• 中文名: 2-(甲基亚磺酰)苯酚
• 英文名: 2-(Methylsulfinyl)phenol
• 中文别名: 2-(甲基亚磺酰基)苯醇

2-(甲基亚磺酰)苯酚物理化学性质

• 密度: 1.36g/cm3
• 沸点: 327.9ºC at 760 mmHg
• 熔点: 118-122ºC
• 分子式: C₇H₈O₂S
• 分子量: 156.20200
• 闪点: 152.1ºC
• 精确质量: 156.02500
• PSA: 56.51000
• LogP: 1.99530
• InChIKey: VMTHIQRJDDCEQD-UHFFFAOYSA-N
• SMILES: CS(=O)c1ccccc1O
• 蒸汽压: 0.000103mmHg at 25°C
• 折射率: 1.653
• 分子结构:

  1、 摩尔折射率：41.78

  2、 摩尔体积（cm³/mol）：114.1

  3、 等张比容（90.2K）：331.8

  4、 表面张力（dyne/cm）：71.5

  5、 极化率（10-24cm3）：16.56

• 计算化学:

  1.疏水参数计算参考值（XlogP）:1.2

  2.氢键供体数量:1

  3.氢键受体数量:3

  4.可旋转化学键数量:1

  5.互变异构体数量:3

  6.拓扑分子极性表面积56.5

  7.重原子数量:10

  8.表面电荷:0

  9.复杂度:136

  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:1

  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）：118-122

2-(甲基亚磺酰)苯酚MSDS

2-(甲基亚磺酰)苯酚MSDS英文版

2-(甲基亚磺酰)苯酚安全信息

• 危害码 (欧洲): Xi
• 海关编码: 2930909090

2-(甲基亚磺酰)苯酚海关

• 海关编码: 2930909090
• 中文概述: 2930909090. 其他有机硫化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:30.0%
• 申报要素: 品名, 成分含量, 用途
• Summary: 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

2-(甲基亚磺酰)苯酚靶点实验

查看更多实验

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：Flow Cytometric HTS Screen for inhibitors of the ABC transporter ABCB6 for Validation... 来源：NMMLSC 靶标：ATP-binding cassette sub-family B member 6, mitochondrial [Homo sapiens] External Id：UNMCMD_ABCB6_1o_ValidationSet

实验名称：Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste... 来源：Broad Institute 靶标：N/A External Id：7124-01_Inhibitor_SinglePoint_HTS_Activity

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2-(甲基亚磺酰)苯酚英文别名

• 2-methylsulfinylphenol