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1,4-二氨基-2-甲氧基苯 | 5307-02-8

中文名称
1,4-二氨基-2-甲氧基苯
中文别名
——
英文名称
2-methoxy-1,4-phenylenediamine
英文别名
2,5-diaminoanisole;2-methoxybenzene-1,4-diamine
1,4-二氨基-2-甲氧基苯化学式
CAS
5307-02-8
化学式
C7H10N2O
mdl
MFCD00466319
分子量
138.169
InChiKey
HGUYBLVGLMAUFF-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

物化性质

  • 熔点:
    103.5 °C(Solv: benzene (71-43-2))
  • 沸点:
    253.57°C (rough estimate)
  • 密度:
    1.1315 (rough estimate)
  • 颜色/状态:
    Crystals
  • 溶解度:
    In water, 1.57X10+5 mg/L at 25 °C (est)
  • 蒸汽压力:
    1.32X10-3 mm Hg at 25 °C (est)
  • 分解:
    When heated to decomposition it emits toxic vapor of /nitrogen oxides/.

计算性质

  • 辛醇/水分配系数(LogP):
    0.5
  • 重原子数:
    10
  • 可旋转键数:
    1
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.142
  • 拓扑面积:
    61.3
  • 氢给体数:
    2
  • 氢受体数:
    3

ADMET

毒理性
  • 副作用
职业性肝毒素 - 第二性肝毒素:在职业环境中的毒性效应潜力是基于人类摄入或动物实验的中毒案例。 高铁血红蛋白血症 - 血液中高铁血红蛋白含量增加;该化合物被归类为第二毒性效应 皮肤致敏剂 - 能诱导皮肤过敏反应的制剂。
Occupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation. Methemoglobinemia - The presence of increased methemoglobin in the blood; the compound is classified as secondary toxic effect Skin Sensitizer - An agent that can induce an allergic reaction in the skin.
来源:Haz-Map, Information on Hazardous Chemicals and Occupational Diseases
毒理性
  • 相互作用
60只6-8周大的Sprague-Dawley雄性和雌性大鼠接受了一种含有0.4% 2-氨基-4-硝基酚、6.0% 2,5-二氨基苯甲醚硫酸盐、2.0% 雷锁辛、0.3% 邻-氨基酚、5.0% 油酸、3.0% 异丙醇、0.2% 硫代硫酸钠、6.0% 氨水(29%)和水的氧化染发配方(7405)的局部应用。该配方被等体积的6% 过氧化氢稀释,每周两次将0.5毫升应用于剃光的背部区域(直径约2.5厘米),直到第117周。治疗组和对照组的平均体重和存活率相似。未观察到皮肤肿瘤。与对照组之一相比,雄性垂体腺瘤的发生率增加35/52(67%)对14/49;P < 0.01;X2检验),并且在治疗动物与对照组动物相比,未观察到任何其他部位肿瘤发生率的增加。
... Groups of 60 male and female Sprague-Dawley rats 6-8 weeks of age received topical applications of an oxidative hair-dye formulation (7405) containing 0.4% 2-amino-4-nitrophenol, 6.0% 2,5-diaminoanisole sulfate, 2.0% resorcinol, 0.3% ortho-aminophenol, 5.0% oleic acid, 3.0% isopropanol, 0.2% sodium sulfite, 6.0% ammonia (29%) and water to 100%. The formulation was diluted in an equal volume of 6% hydrogen peroxide, and 0.5 mL was applied to a shaved area of the back (approx. 2.5 cm in diameter) twice a week up to week 117. Mean body weights and survival were similar in treated and control groups. No skin tumors were observed. The incidence of pituitary adenomas was increased in males in comparison with one of the control groups 35/52 (67%) versus 14/49; P < 0.01; X2-test), and no increase in the incidence of tumors at any other site was observed in treated as compared with control animals. ...
来源:Hazardous Substances Data Bank (HSDB)
毒理性
  • 解毒与急救
/SRP:/ 立即急救:确保已经进行了充分的中和。如果患者停止呼吸,请开始人工呼吸,最好使用需求阀复苏器、袋阀面罩装置或口袋面罩,按训练操作。如有必要,执行心肺复苏。立即用缓慢流动的水冲洗受污染的眼睛。不要催吐。如果发生呕吐,让患者前倾或将其置于左侧(如果可能的话,头部向下)以保持呼吸道畅通,防止吸入。保持患者安静,维持正常体温。寻求医疗帮助。 /有机碱/胺类及相关化合物/
/SRP:/ Immediate first aid: Ensure that adequate decontamination has been carried out. If patient is not breathing, start artificial respiration, preferably with a demand valve resuscitator, bag-valve-mask device, or pocket mask, as trained. Perform CPR if necessary. Immediately flush contaminated eyes with gently flowing water. Do not induce vomiting. If vomiting occurs, lean patient forward or place on the left side (head-down position, if possible) to maintain an open airway and prevent aspiration. Keep patient quiet and maintain normal body temperature. Obtain medical attention. /Organic bases/Amines and related compounds/
来源:Hazardous Substances Data Bank (HSDB)
毒理性
  • 解毒与急救
/SRP:/ 基本治疗:建立专利气道(如有需要,使用口咽或鼻咽气道)。如有必要,进行吸痰。密切观察呼吸不足的迹象,如有必要,进行辅助通气。通过非重复呼吸面罩以10至15升/分钟的速度给予氧气。监测肺水肿,并在必要时进行治疗……。监测休克,并在必要时进行治疗……。预防癫痫发作,并在必要时进行治疗……。对于眼睛污染,立即用水冲洗眼睛。在运输过程中,用0.9%的生理盐水(NS)持续冲洗每只眼睛……。不要使用催吐剂。对于摄入,如果患者能够吞咽、有强烈的干呕反射且不流口水,则用温水冲洗口腔,并给予5毫升/千克,最多200毫升的水进行稀释。给予活性炭……。在去污后,用干燥的无菌敷料覆盖皮肤烧伤……。/有机碱/胺类及相关化合物/
/SRP:/ Basic treatment: Establish a patent airway (oropharyngeal or nasopharyngeal airway, if needed). Suction if necessary. Watch for signs of respiratory insufficiency and assist ventilations if necessary. Administer oxygen by nonrebreather mask at 10 to 15 L/min. Monitor for pulmonary edema and treat if necessary ... . Monitor for shock and treat if necessary ... . Anticipate seizures and treat if necessary ... . For eye contamination, flush eyes immediately with water. Irrigate each eye continuously with 0.9% saline (NS) during transport ... . Do not use emetics. For ingestion, rinse mouth and administer 5 mL/kg up to 200 mL of water for dilution if the patent can swallow, has a strong gag reflex, and does not drool. Administer activated charcoal ... . Cover skin burns with dry sterile dressings after decontamination ... . /Organic bases/Amines and related compounds/
来源:Hazardous Substances Data Bank (HSDB)
毒理性
  • 解毒与急救
/SRP:/ 高级治疗:对于昏迷、严重肺水肿或严重呼吸困难的病人,考虑进行口咽或鼻咽气管插管以控制气道。使用气囊阀面罩装置的正压通气技术可能有益。考虑使用药物治疗肺水肿...。监测心率和必要时治疗心律失常...。开始静脉输注D5W /SRP: "保持开放",最低流量/。如果出现低血容量的迹象,使用0.9%生理盐水(NS)或乳酸钠林格氏液(LR)。对于伴有低血容量迹象的低血压,谨慎给予液体。如果病人对这些措施无反应,血管加压药可能有所帮助。注意观察液体过载的迹象...。如果病人在严重低氧血症、发绀和心脏受损(对氧疗无反应)的情况下出现症状,给予1%亚甲蓝溶液。 ...。用地西泮或劳拉西泮治疗癫痫...。使用丙美卡因氢氯化物协助眼部冲洗...。 /有机碱/胺及相关化合物/
/SRP:/ Advanced treatment: Consider orotracheal or nasotracheal intubation for airway control in the patient who is unconscious, has severe pulmonary edema, or is in severe respiratory distress. Positive-pressure ventilation techniques with a bag-valve-mask device may be beneficial. Consider drug therapy for pulmonary edema ... . Monitor cardiac rhythm and treat arrhythmias as necessary ... . Start IV administration of D5W /SRP: "To keep open", minimal flow rate/. Use 0.9% saline (NS) or lactated Ringer's (LR) if signs of hypovolemia are present. For hypotension with signs of hypovolemia, administer fluid cautiously. If patient is unresponsive to these measures, vasopressors may be helpful. Watch for signs of fluid overload ... . Administer 1% solution methylene blue if patient is symptomatic with severe hypoxia, cyanosis, and cardiac compromise not responding to oxygen. ... . Treat seizures with diazepam or lorazepam ... . Use proparacaine hydrochloride to assist eye irrigation ... . /Organic bases/Amines and related compounds/
来源:Hazardous Substances Data Bank (HSDB)
吸收、分配和排泄
染发产品中的2,5-DAA(含量1.9%,与H2O2按1:1混合)在5名女性志愿者洗净的头发上涂抹(27-32分钟)后,皮肤吸收量小于所施加量的0.102%,假设染料的分布在整个身体是均匀的。
Skin absorption of a hair dye product with 2,5-DAA (1.9%, mixed 1:1 with H2O2) applied (27-32 min) on washed hair of 5 female volunteers was less than 0.102% of the amount applied, under hypothesis that distribution of the dye is equal in the whole body.
来源:Hazardous Substances Data Bank (HSDB)
吸收、分配和排泄
(14)C-2,5-DAA.2HCl(水溶液)在没有过氧化氢的情况下涂抹于皮肤上:OFA-Sprague-Dawley大鼠,每平方厘米2毫克(游离碱)的剂量显示出1.02%的涂抹量被吸收。(14)C-2,5-DAA.2HCl在商业制剂中(与6% H2O2按1:1比例混合)涂抹于剃毛区的皮肤,每平方厘米2毫克(游离碱)的剂量在未剃毛的皮肤上显示出0.28%(剃毛皮肤)和0.07%(未剃毛皮肤)的吸收率。
(14)C-2,5-DAA.2HCl (aqueous solution) applied epicutaneously without hydrogen peroxide on HIM: OFA-Sprague-Dawley rats at 2 mg (free base)/sq cm showed that 1.02% of the amount applied was absorbed. (14)C-2,5-DAA.2HCl in commercial preparation (1;1 with 6% H2O2) after epicutaneous applications on sq cm of clipped skin areas and 2 mg (free base)/sq cm on unclipped skin showed an absorption of 0.28% (clipped skin) and 0.07% (unclipped skin).
来源:Hazardous Substances Data Bank (HSDB)

安全信息

  • 海关编码:
    2922299090
  • 危险性防范说明:
    P261,P280,P305+P351+P338
  • 危险性描述:
    H302+H312+H332,H315,H319,H335
  • 储存条件:
    室温

SDS

SDS:c4d35e5aeea829da5ace2d1de2df8404
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上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量
  • 下游产品
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    描述:
    1,4-二氨基-2-甲氧基苯硫酸硝酸sodium 2-nitrobenzenesulfonate 作用下, 以 吡啶 为溶剂, 反应 8.0h, 生成 泛喹酮
    参考文献:
    名称:
    Facile Synthesis of Tetrapyrido[2,3-a:3',2'-c:2",3"-h:3'",2'"-j]phenazine
    摘要:
    标题化合物是一种潜在的过渡金属配体,由两个 4,7-菲罗啉-5,6-二酮分子在氨存在的还原条件下偶联制备而成。此外,还介绍了 4,7-菲罗啉-5,6-二酮的直接合成方法。
    DOI:
    10.1055/s-1997-956
  • 作为产物:
    参考文献:
    名称:
    Highly selective optical monitoring of O2via multiple-channels
    摘要:
    概述了用于检测 O2 的光学探针。基于氧化还原的多响应传感器系统具有高度选择性,并且可以使用传统光谱技术(例如紫外-可见光、红外或荧光)以光学方式监测响应,也可以通过肉眼观察对比色从浅黄色到深色的变化来监测响应红色的。
    DOI:
    10.1039/c2ra22292b
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文献信息

  • Self-Assembled Magnetic Gold Catalysts from Dual-Functional Boron Clusters
    作者:Bin Qi、Chenchen Wu、Xin Li、Dan Wang、Liang Sun、Bo Chen、Wenjing Liu、Haibo Zhang、Xiaohai Zhou
    DOI:10.1002/cctc.201702011
    日期:2018.5.24
    A new class of core–shell magnetic gold nanocomposites is prepared in a raspberry‐like fashion by the controlled supramolecular host–guest assembly of γ‐cyclodextrins (γ‐CDs) and boron clusters. In this work, Cs2[closo‐B12H12], a fundamental boron cluster, can play a dual role in the preparation of highly monodispersed Au nanoparticles and in the immobilization of Au nanoparticles on the γ‐CDs@Fe3O4
    通过控制γ-环糊精(γ-CDs)和硼团簇的超分子主体-客体组装,以覆盆子状的方式制备了新型的核-壳磁性金纳米复合材料。在这项工作中,基本的硼簇Cs 2 [ closo- B 12 H 12 ]可以在制备高度单分散的Au纳米颗粒以及将Au纳米颗粒固定在γ-CDs@ Fe 3 O 4上起双重作用。表面作为有效的锚点。这种简便而自发的超分子策略可以控制高度稳定的金复合材料的尺寸和组成。此外,获得的AuNPs @ Fe 3 O 4 复合材料具有优异的催化活性和可再循环性,可将硝基芳族化合物选择性还原为相应的苯胺化合物,并且在20 s内即可实现最快的反应,并且在室温下具有较高的转化率和选择性,这比之前在SiO2研究中获得的要好。金属纳米颗粒复合材料作为催化剂。
  • HAIR COLORING COMPOSITIONS
    申请人:——
    公开号:US20020032933A1
    公开(公告)日:2002-03-21
    A hair coloring composition comprising: (a) from about 0.0003 moles (per 100 g of composition) to less than about 0.09 moles (per 100 g of composition) of an inorganic peroxygen oxidizing agent; and (b) an oxidative hair coloring agent; wherein the pH of each of (a) and (b) is in the range of from about 1 to about 6 and wherein the combined mixture of (a) and (b) has a pH in the range of from about 1 to about 6. The products can provide excellent hair coloring and in-use efficacy benefits including excellent initial color and good wash fastness in combination with reduced hair damage at low pH.
    一种染发组合物,包括:(a)约0.0003摩尔(每100克组合物)至约0.09摩尔(每100克组合物)的无机过氧化氧化剂;和(b)氧化性染发剂;其中(a)和(b)的pH值在约1至约6的范围内,且(a)和(b)的混合物的pH值在约1至约6的范围内。该产品可以提供出色的染发效果和使用效果,包括出色的初始颜色和良好的耐洗性,同时在低pH值下减少头发损伤。
  • Hair colouring and conditioning compositions
    申请人:The Procter & Gamble Company
    公开号:US20030113286A1
    公开(公告)日:2003-06-19
    A hair colouring and conditioning composition comprising: (a) a hair colouring agent; and (b) a hair conditioning agent; wherein the composition provides an Average Combing Index Value of greater than 1.2 as measured by the Combing Technical Test Method. The products can provide excellent hair colouring together with excellent conditioning, reduced hair damage, brittleness and dryness, and is convenient and easy to use.
    一种包括: (a) 染发剂;和 (b) 护发剂; 的染发和护理组合物; 其中该组合物通过梳理技术测试方法测得的平均梳理指数值大于1.2。 该产品可以提供优秀的染发效果以及优秀的护理效果,减少头发损伤、脆弱和干燥,且使用方便。
  • Compositions for oxidatively dyeing keratin fibers and methods for using such compositions
    申请人:Lim Mu'Ill
    公开号:US20070209123A1
    公开(公告)日:2007-09-13
    Compositions for dyeing keratin fibers comprise (a) at least one keratin dyeing compound selected from aromatic systems which comprise at least one boronic acid or boronic ester moiety and which are capable of forming upon oxidation a nucleophile or an electrophile, (b) at least one additional keratin dyeing compound selected from the group consisting of auxiliary developers and auxiliary couplers, and (c) a cosmetically suitable medium. Methods for oxidatively dyeing keratin fibers comprise the steps of applying such compositions in the presence of an oxidizing agent and rinsing the hair. A hair coloring product in kit form comprises a first separately packaged container comprising a composition as described above and a second separately packaged container comprising an oxidizing agent.
    用于染色的组合物包括:(a)至少一种选自含有至少一个硼酸或硼酸酯基团的芳香族系统的角蛋白染料化合物,这些化合物在氧化时能够形成亲核物或亲电子物;(b)至少一种额外的角蛋白染料化合物,选自辅助显色剂和辅助偶联剂的组合;(c)一种化妆品适用的介质。氧化染角蛋白纤维的方法包括在氧化剂存在下应用这样的组合物,并冲洗头发。一种套装形式的头发染色产品包括一个第一独立包装容器,其中包含上述描述的组合物,以及一个第二独立包装容器,其中包含氧化剂。
  • NOVEL COMPOUND HAVING MULTIMER STRUCTURE OF XANTHENE DERIVATIVE, COLORING COMPOSITION, INK FOR INKJET RECORDING, METHOD OF INKJET RECORDING, COLOR FILTER, AND COLOR TONER
    申请人:FUJIFILM CORPORATION
    公开号:US20140176653A1
    公开(公告)日:2014-06-26
    There is provided a compound represented by formula (1): in formula (1), L represents a divalent to tetravalent linking group; D represents a residue obtained by removing 1 to 5 hydrogen atoms from a compound represented by formula (2); m represents an integer of 1 to 10, however, each L may be the same with or different from every other L; n represents an integer of 2 to 10, however, each D may be the same with or different from every other D; and in formula (2), each of R 4 to R 24 independently represents a hydrogen atom or a substituent, provided that formula (2) has at least one or more ionic hydrophilic groups.
    提供了一种由公式(1)表示的化合物:在公式(1)中,L代表二价到四价的连接基团;D代表通过从由公式(2)表示的化合物中去除1到5个氢原子获得的残基;m代表1到10的整数,但是,每个L可以相同也可以不同于其他L;n代表2到10的整数,但是,每个D可以相同也可以不同于其他D;在公式(2)中,R4到R24中的每一个独立地代表一个氢原子或一个取代基,前提是公式(2)至少有一个或更多的离子亲水基团。
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