CAS: 4707-47-5; Methyl 2,4-Dihydroxy-3,6-Dimethylbenzoate

该化合物是一种自然形成的有机化合物,被归类为悬浮物,主要见于地衣物种,其特点是其苯球结构,有助于其发挥潜在生物活动的二级代谢物的作用;该化合物在标准条件下具有显著稳定性,适合于植物化学和天然产品研究的研究应用;其分子框架允许衍生,有利于合成化学的探索;亚甲酸具有可能的抗微生物和抗氧化特性,尽管需要进一步研究以证实这些影响;该化合物通常通过色谱技术孤立,确保分析或实验用途高度纯度.

英文名称Methyl 2,4-Dihydroxy-3,6-Dimethylbenzoate
中文名称橡苔
IUPAC名称methyl 2,4-dihydroxy-3,6-dimethylbenzoate
其它别名Methyldioctadecylamine; Methyl Atrarate; Atraric Acid; Ethanone, 1,1'-(1,1'-Biphenyl)-4,4'-Diylbis(2-Bromo-; Methyl Atratate, >=; Beta-Resorcyclic Acid, 3,6-Dimethyl-, Methyl Este
CAS编号4707-47-5
MFCD编号:MFCD00157202
EINECS号:225-193-0
FDA UNII编号:12YH9T04QE
分子式:C10H12O4
分子量:196.2
产品CID: 1465378
产品分类有机原料→分子砌块→芳环类化合物→苯类化合物

相似结构搜索
产品信息参考;;;;
InChIKey: UUQHKWMIDYRWHH-UHFFFAOYSA-N
InChI=1S/C10H12O4/c1-5-4-7(11)6(2)9(12)8(5)10(13)14-3/h4,11-12H,1-3H3…
计算化学: 氢键受体数4.0氢键供体数2.0可旋转键数1.0

物理性质

熔点141-146 °C
沸点360.7±22.0 °C at 760 mmHg
闪点143.9±15.8 °C
密度1.3±0.1 g/cm3
pKa:8.63±0.28(预测)
PSA:66.76
LogP:1.50124
折射率1.570
蒸汽压0.0±0.8 mmHg at 25°C
溶解性Soluble In Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,Etc.
敏感性常温常压下稳定
外观形态白色至类白色粉末
储存条件存储低于 +30°C.
产品应用该化合物用于作用和孕育剂,促使对人类前列腺癌细胞中的上皮利耳-脑细胞转型因素做出不同反应.
性质描述熔点 141-146°C

MSDS等安全信息

GHS象形图
GHS符号GHS07;
注释: Exclamation mark
危险类别皮肤致敏类别1B
特定目标器官毒性 - 单次接触类别3
皮肤腐蚀/刺激类别2
严重眼刺激类别2
警示词Warning(警告)
危险描述H317 |可能引起皮肤过敏反应.
H335 |可能引起呼吸道刺激.
H315 |造成皮肤刺激.
H319 |造成严重眼刺激.
防范说明P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
UN编号NONH for all modes of transport
危险品标志Xi
安全声明26-36
危险类别码36/37/38
WGK Germany2

欧盟法规

REACH注册ECHA物质C&L通报REACH预注册

上下游产品

合成工艺路线路线简述

2,4-Dihydroxy-3,6-Dimethylbenzaldehyde置于sodium Hydroxide,Potassium Permanganate,乙醚,丙酮体系中,化学反应生成橡苔
参考文献:Fujikawa,Yakugaku Zasshi/journal Of The Pharmaceutical Society Of Japan,1936,Vol. 56,P. 237,245; Dtsch. Ref. S. 25,27
标题:Fujikawa,Yakugaku Zasshi/journal Of The Pharmaceutical Society Of Japan,1936,Vol. 56,P. 237,245; Dtsch. Ref. S. 25,27

海关参考信息

2906210000-苄醇
2907221000-对苯二酚
2912110000-甲醛
2912210000-苯甲醛
💡 提示：海关信息按照顺序优先匹配，如需确认的海关信息，请参考相关资料。
详情请参考：📖 海关编码查询和海关进出口税则

专利信息

专利号:US-8481519-B2
优先权日:2005-02-05
标题 :Isolation of atraric acid, synthesis of atraric acid derivatives, and use of atraric acid and the derivatives thereof for the treatment of benign prostatic hyperplasia, prostate carcinoma and spinobulbar muscular atrophy
发明人：HOFFMANN HANS-RAINER; MATUSCH RUDOLF; BANIAHMAD ARIA
权利人:HOFFMANN HANS-RAINER; MATUSCH RUDOLF; BANIAHMAD ARIA; LOHMANN THERAPIE SYST LTS
摘要:A method for isolating atraric acid from biological material, atraric acid derivatives, the chemical synthesis thereof, and the use of atraric acid and the derivatives thereof for treating or producing a medicament for treating benign prostate hyperplasia, prostate carcinoma or spinobulbar muscular atrophy is provided. In addition, a basic substance for the development of other agents used for treating benign prostate hyperplasia, prostate carcinoma, or spinobulbar muscular atrophy is provided.

专利号:US-2009143466-A1
优先权日:2005-02-05
标题 :Isolation of Atraric Acid, Synthesis of Atraric Acid Derivatives, and Use of Atraric Acid and the Derivatives Thereof for the Treatment of Benign Prostatic Hyperplasia, Prostate Carcinoma and Spinobulbar Muscular Atrophy

专利号:CA-2596634-C
优先权日:2005-02-05
标题 :Isolation of atraric acid, synthesis of atraric acid derivatives, and use of atraric acid and the derivatives thereof for the treatment of benign prostatic hyperplasia, prostate carcinoma and spinobulbar muscular atrophy

专利号:ZA-200706107-B
优先权日:2005-02-05
标题 :Isolation of atraric acid, synthesis of atraric acid derivatives, and use of atraric acid and the derivatives thereof for the treatment of benign prostate hyperplasia, prostate carcinoma, and spinobulbar muscular atrophy

专利号:JP-2008528648-A
优先权日:2005-02-05
标题:Isolation of atralic acid, synthesis of atralic acid derivatives, and use of atralic acid and its derivatives for the treatment of benign prostatic hyperplasia, prostate malignancies and bulbar spinal muscular atrophy

专利号:BR-PI0606833-A2
优先权日:2005-02-05
标题 :2,4-dihydroxy-3-methylbenzoate, medicine for the treatment of prostatic hyperplasia, prostate carcinoma or spino-bulbar muscle atrophy, 2,4-dihydroxy-3-methylbenzoate, process for isolation of atraric acid from of a biological material and process for the synthesis of atric acid derivatives

其他信息查阅

江西伯业医药科技有限公司

网址: http://www.boyepharm.com
企业联系电话：18971341812(同微信);QQ1564214480👤
地址:江西省新余市渝水区解放东路19号

⚠️ 未注册 · 未认证企业

备注: 📌 数据来源说明：本展台内容基于各搜索引擎等公开数据整理，仅作展示用途。请用户自行辨别
✉️ 若企业需抹除展台内容或有异议，请通过页面底部联系方式告知我们，我们会尽快处理。

盐城鸿泰生物工程有限公司

网址: http://www.hongtaibiochem.com
企业联系电话：0515-86111688;86221388;86098099👤
地址:江苏省建湖县向阳西路271号

⚠️ 未注册 · 未认证企业

常熟市联创化学有限公司

网址: http://www.leaguechemical.com
企业联系电话：0512-52546388;13915608587👤
地址:江苏省常熟市何市镇

⚠️ 未注册 · 未认证企业

河南香多实业有限公司

网址: http://www.xiangduochem.com
企业联系电话：15981848961,18638673268👤
地址:河南省郑州市中原区冉屯路55号

⚠️ 未注册 · 未认证企业

上海先臣化工有限公司

网址: http://www.xinchem.com
企业联系电话：021-64606569👤
地址:兴梅路485号(中环科技园)闵行区

⚠️ 未注册 · 未认证企业

巨野众悦香料有限公司

网址: http://www.zhongyuearoma.com
企业联系电话：0530-8599699 13701896116👤
地址:山东省菏泽市巨野县煤化工业园(董官屯)

⚠️ 未注册 · 未认证企业

第 1 / 1 页

供应商参考报价(招募中)

品牌试剂参考报价(招募中)

实用工具

📌 第三方产品分析报告

✅ COA系统入驻 | 共享模式

主要参考文献

[参考文献]: Papaioannou M, Et Al. The Natural Compound Atraric Acid Is An Antagonist Of The Human Androgen Receptor Inhibiting Cellular Invasiveness And Prostate Cancer Cell Growth. J Cell Mol Med. 2009 Aug;13(8B):2210-2223.
[参考文献]: Roell D, Baniahmad A. The Natural Compounds Atraric Acid And N-Butylbenzene-Sulfonamide As Antagonists Of The Human Androgen Receptor And Inhibitors Of Prostate Cancer Cell Growth. Mol Cell Endocrinol. 2011 Jan 30;332(1-2):1-8.

合成参考文献

参考文献:10.1021/np9803777
摘要:Kumar KC S, Müller K. Lichen Metabolites. 1. Inhibitory Action Against Leukotriene B₄Biosynthesis by a Non-Redox Mechanism. J. Nat. Prod. 1999 May 06;62(6):817–20. doi: 10.1021/np9803777.
参考文献:10.1021/np980378z
摘要:Kumar KC, Müller K. Lichen metabolites. 2. Antiproliferative and cytotoxic activity of gyrophoric, usnic, and diffractaic acid on human keratinocyte growth. J Nat Prod. 1999 Jun;62(6):821–3. doi: 10.1021/np980378z.
参考文献:10.1055/s-2006-941472
摘要:Schleich S, Papaioannou M, Baniahmad A, Matusch R. Activity-guided isolation of an antiandrogenic compound of Pygeum africanum. Planta Med. 2006 May;72(6):547–51. doi: 10.1055/s-2006-941472.
参考文献:10.1186/s12906-017-1572-z
摘要:Njateng GSS, Du Z, Gatsing D, Mouokeu RS, Liu Y, Zang H, Gu J, Luo X, Kuiate J. Antibacterial and antioxidant properties of crude extract, fractions and compounds from the stem bark of Polyscias fulva Hiern (Araliaceae). BMC Complementary Medicine and Therapies. 2017 Feb 07;17(1):99. doi: 10.1186/s12906-017-1572-z.

📝 需求与反馈

📲 手机号 / 邮箱 *

✏️ 问题内容 *

尽可能描述清楚需求与问题信息

CAS: 4707-47-5; Methyl 2,4-Dihydroxy-3,6-Dimethylbenzoate

物理性质

MSDS等安全信息

欧盟法规

上下游产品

合成工艺路线路线简述

海关参考信息

专利信息

其他信息查阅

供应商参考报价(招募中)

品牌试剂参考报价(招募中)

实用工具

📌 第三方产品分析报告

主要参考文献

合成参考文献

通知