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6,6-dimethyl-1-(2-methylphenyl)-1,3,5-triazine-2,4-diamine

更新时间:2026-06-30 20:04:04

6,6-dimethyl-1-(2-methylphenyl)-1,3,5-triazine-2,4-diamine结构式
6,6-dimethyl-1-(2-methylphenyl)-1,3,5-triazine-2,4-diamine结构式
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常用名 6,6-dimethyl-1-(2-methylphenyl)-1,3,5-triazine-2,4-diamine 英文名 6,6-dimethyl-1-(2-methylphenyl)-1,3,5-triazine-2,4-diamine
CAS号 75191-45-6 分子量 267.75800
密度 1.24g/cm3 沸点 369.5ºC at 760 mmHg
分子式 C12H18ClN5 熔点 N/A
MSDS N/A 闪点 177.2ºC

 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 6,6-dimethyl-1-(2-methylphenyl)-1,3,5-triazine-2,4-diamine,hydrochloride

 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 1.24g/cm3
沸点 369.5ºC at 760 mmHg
分子式 C12H18ClN5
分子量 267.75800
闪点 177.2ºC
精确质量 267.12500
PSA 80.00000
LogP 2.31930
InChIKey ZOENGZJNZQOXEL-UHFFFAOYSA-N
SMILES Cc1ccccc1N1C(N)=NC(N)=NC1(C)C.Cl
折射率 1.638

 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。

~%

6,6-dimethyl-1-(2-methylphenyl)-1,3,5-triazine-2,4-diamine结构式

6,6-dimethyl-1-...

75191-45-6

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文献:Ma, Xiang; Poon, Thong-Yuen; Wong, Peter Tsun Hon; Chui, Wai-Keung Bioorganic and Medicinal Chemistry Letters, 2009 , vol. 19, # 19 p. 5644 - 5647

~%

6,6-dimethyl-1-(2-methylphenyl)-1,3,5-triazine-2,4-diamine结构式

6,6-dimethyl-1-...

75191-45-6

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文献:Modest; Levine Journal of Organic Chemistry, 1956 , vol. 21, p. 14,16

~%

6,6-dimethyl-1-(2-methylphenyl)-1,3,5-triazine-2,4-diamine结构式

6,6-dimethyl-1-...

75191-45-6

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文献:Modest Journal of Organic Chemistry, 1956 , vol. 21, p. 1,12

 上下游产品

本表列出该化学品对应的上游起始原料以及下游衍生产物清单。

上游产品  4

下游产品  0

 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: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
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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 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: 75191-45-6的极性表面积PSA是多少?
A: 75191-45-6极性表面积PSA为80.00000。
Q: 75191-45-6的CAS号是多少?
A: 75191-45-6CAS号为75191-45-6。
Q: 75191-45-6的SMILES表达式是什么?
A: 75191-45-6SMILES表达式为Cc1ccccc1N1C(N)=NC(N)=NC1(C)C.Cl。
Q: 75191-45-6的分子式是什么?
A: 75191-45-6分子式为C12H18ClN5。
Q: 75191-45-6的InChIKey是什么?
A: 75191-45-6InChIKey为ZOENGZJNZQOXEL-UHFFFAOYSA-N。
Q: 75191-45-6的上游原料有哪些?
A: 75191-45-6相关上游原料(CAS):67-64-1;95-53-4;93-69-6;636-21-5。
Q: 75191-45-6的分子量是多少?
A: 75191-45-6分子量为267.75800。
Q: 75191-45-6的沸点是多少?
A: 75191-45-6沸点为369.5ºC at 760 mmHg。
Q: 75191-45-6的LogP(油水分配系数)是多少?
A: 75191-45-6LogP(油水分配系数)为2.31930。
Q: 75191-45-6的中文名称是什么?
A: 75191-45-6的中文名称为75191-45-6。
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