2,5-二叔丁基-4-甲氧基苯酚结构式
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常用名 | 2,5-二叔丁基-4-甲氧基苯酚 | 英文名 | 2,5-DI-TERT-BUTYL-4-HYDROXYANISOLE |
|---|---|---|---|---|
| CAS号 | 1991-52-2 | 分子量 | 236.35000 | |
| 密度 | 0.963 g/cm3 | 沸点 | 337.8ºC at 760 mmHg | |
| 分子式 | C15H24O2 | 熔点 | 99-102ºC(lit.) | |
| MSDS | 中文版 美版 | 闪点 | 129.2ºC | |
| 符号 |
GHS07 |
信号词 | Warning |
| 中文名 | 2,5-二叔丁基-4-甲氧基苯酚 |
|---|---|
| 英文名 | 2,5-ditert-butyl-4-methoxyphenol |
| 中文别名 | 2,5-二叔丁基-4-羟基苯甲醚 | 2,5-二-叔丁基-4-羟基苯甲醚 |
| 英文别名 | 更多 |
| 密度 | 0.963 g/cm3 |
|---|---|
| 沸点 | 337.8ºC at 760 mmHg |
| 熔点 | 99-102ºC(lit.) |
| 分子式 | C15H24O2 |
| 分子量 | 236.35000 |
| 闪点 | 129.2ºC |
| 精确质量 | 236.17800 |
| PSA | 29.46000 |
| LogP | 3.99580 |
| InChIKey | FLLRQABPKFCXSO-UHFFFAOYSA-N |
| SMILES | COc1cc(C(C)(C)C)c(O)cc1C(C)(C)C |
| 外观性状 | Crystalline Powder,White to cream |
| 蒸汽压 | 5.25E-05mmHg at 25°C |
| 折射率 | 1.495 |
| 储存条件 | 密闭,阴凉干燥处保存 |
| 稳定性 | 常温常压下稳定 |
| 分子结构 | 1、 摩尔折射率:71.58 2、 摩尔体积(m3/mol):245.2 3、 等张比容(90.2K):575.0 4、 表面张力(dyne/cm):30.2 5、 介电常数(F/m):无可用 6、 偶极距(D):无可用 7、 极化率(10 -24cm 3):28.37 |
| 计算化学 | 1.疏水参数计算参考值(XlogP):4.9 2.氢键供体数量:1 3.氢键受体数量:2 4.可旋转化学键数量:3 5.互变异构体数量:3 6.拓扑分子极性表面积29.5 7.重原子数量:17 8.表面电荷:0 9.复杂度:247 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. 性状:未确定 2. 密度(g/mLat 20°C):未确定 3. 相对蒸汽密度(g/mL,空气=1):未确定 4. 熔点(ºC):99-102 5. 沸点(ºC,常压):未确定 6. 沸点(ºC,12mmHg):未确定 7. 折射率(n20/D):未确定 8. 闪点(ºC):未确定 9. 比旋光度(º):未确定 10. 自燃点或引燃温度(ºC):未确定 11. 蒸气压(hPa,25ºC):未确定 12. 饱和蒸气压(kPa,114.4 ºC):未确定 13. 燃烧热(KJ/mol):未确定 14. 临界温度(ºC):未确定 15. 临界压力(MPa):未确定 16. 油水(辛醇/水)分配系数的对数值:未确定 17. 爆炸上限(%,V/V):未确定 18. 爆炸下限(%,V/V):未确定 19. 溶解性:未确定 |
| 符号 |
GHS07 |
|---|---|
| 信号词 | Warning |
| 危害声明 | H315-H319-H335 |
| 警示性声明 | P261-P305 + P351 + P338 |
| 个人防护装备 | dust mask type N95 (US);Eyeshields;Gloves |
| 危害码 (欧洲) | Xi: Irritant; |
| 风险声明 (欧洲) | R36/37/38 |
| 安全声明 (欧洲) | 26-36 |
| 危险品运输编码 | NONH for all modes of transport |
| 海关编码 | 2909500000 |
| 2,5-二叔丁基-4-甲氧基苯酚上游产品 10 | |
|---|---|
| 2,5-二叔丁基-4-甲氧基苯酚下游产品 4 | |
| 海关编码 | 2909500000 |
|---|---|
| 中文概述 | 2909500000. 醚酚、醚醇酚及其卤化、磺化、硝化或亚硝化衍生物. 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% |
| 申报要素 | 品名, 成分含量, 用途 |
| Summary | 2909500000 ether-phenols, ether-alcohol-phenols and their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
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Catalytic activity of anion-exchange resins modified with metal-porphine in oxidative reactions of phenols.
Chem. Pharm. Bull. 48(11) , 1831-2, (2000) Anion-exchange resins modified with metal-porphine (M-Pr) have been investigated to develop a solid catalyst in the oxidative reaction of phenols by O2 in air. Co-Pr, which is easily prepared and sepa... |
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Protective effects of butylated hydroxyanisole and its analogs on the lung toxicity of butylated hydroxytoluene in mice.
Res. Commun. Chem. Pathol. Pharmacol. 50(1) , 125-33, (1985) Dietary administration of butylated hydroxyanisole (BHA) and its analogs, 2-tert-butyl-1,4-dimethoxybenzene, 2,5-di-tert-butyl-4-methoxyphenol, and 2,6-di-tert-butyl-4-methoxyphenol resulted in comple... |
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Sensitive high-performance liquid chromatographic method for the routine determination of butylated hydroxyanisole in plasma.
J. Chromatogr. A. 413 , 282-6, (1987)
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External Id:ERK5 transcriptional activity-HTS
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来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
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External Id:TDP1100
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来源:NCGC
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实验名称:qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
来源:NCGC
靶标:TDP1 protein [Homo sapiens]
External Id:TDP1101
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External Id:IucA Pilot Assay Spectrum Library
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靶标:N/A
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来源:NCGC
靶标:67.9K protein [Vaccinia virus]
External Id:Vaccinia-p2Venus
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实验名称:7124-02: inhibition of TNFa signaling in B cell lineage, counterscreen
来源:Broad Institute
靶标:N/A
External Id:7124-02_CD40 Signaling Pathway_CD40 TNFa Counterscreen
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实验名称:7124-04: Celltiter Glo, Cytotoxicity assay
来源:Broad Institute
靶标:N/A
External Id:7124-04_CD40 Signaling Pathway_CD40 CellTiter-Glo
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| 2,5-di-tert.-butylhydroquinone monomethyl ether |
| 2,5-Di-tert-butyl-4-methoxy-phenol |
| MFCD00274238 |
| 5-Hydroxy-2-methoxy-1.4-di-tert.-butyl-benzol |
| EINECS 217-873-0 |
| 4-methoxy-3,6-di-tert-butylphenol |
| 2,5-Di-t-butyl-4-methoxyphenol |
| 2,5-Di-tert-butyl-4-hydroxyanisole |