CAS: 35034-22-1; 2-Methyl-1H-Imidazole-5-Carbaldehyde

该化合物是一种多用途的七环甲醚,在有机合成和制药应用方面有很大的用途.它的一丁二二二甲二烯核心在五点方位上与一个气态组和二点的甲基替代体一起发挥作用,使它成为构建复杂分子,特别是药用化学中复杂分子的宝贵中间体.该化合物的活性允许进一步衍生,能够合成诸如酶抑制剂和受体调节器等生物活性化合物.它在标准条件下的稳定性和与各种反应条件的兼容性增强了其在多步骤合成路线上的实际作用.这一化合物对于开发有针对性的治疗和农用化学剂特别有用.

英文名称2-Methyl-1H-Imidazole-5-Carbaldehyde
中文名称2-甲基-1H-咪唑-5-甲醛
IUPAC名称2-methyl-1H-imidazole-5-carbaldehyde
其它别名2-甲基-1H-咪唑-4-甲醛; 2-Methyl-1H-Imidazole-4-Carbaldehyde
CAS编号35034-22-1
MFCD编号:MFCD00173725
EINECS号:690-393-0
分子式:C5H6N2O
分子量:110.11
产品CID: 1355192
产品分类有机原料→分子砌块→芳杂环类化合物→咪唑类化合物

相似结构搜索
InChIKey: ZWULFIBGPXWGFG-UHFFFAOYSA-N
InChI=1S/C5H6N2O/c1-4-6-2-5(3-8)7-4/h2-3H,1H3,(H,6,7)…
计算化学: 氢键受体数2.0氢键供体数1.0可旋转键数1.0

相似化合物

39269-74-4 1457-58-5 97602-72-7

MSDS等安全信息

GHS象形图
GHS符号GHS07 & GHS05;
注释: Exclamation mark & Corrosion
危险类别急性毒性类别4(经口)
特定目标器官毒性 - 单次接触类别3
皮肤腐蚀类别1B
严重眼损伤类别1
警示词Danger(危险)
危险描述H302 |吞咽有害.
H335 |可能引起呼吸道刺激.
H314 |造成严重皮肤灼伤和眼损伤.
H318 |造成严重眼损伤.
防范说明P260-P264-P280-P301+P330+P331-P304+P340-P363-P405-P501
危险等级8
UN编号1759.0
危险品标志Xi,C,Xn
风险等级Irritant
包装等级Ⅲ
安全声明26-36/37/39-45-22
危险类别码36/37/38-34-22

欧盟法规

ECHA物质C&L通报

上下游产品

合成工艺路线路线简述

合成目标产物 2-Methyl-1H-Imidazole-4-Carbaldehyde 主要起始原料 Acetamide, N-4-Isoxazolyl-
(文献来源)合成步骤主要原料 Acetamide, N-4-Isoxazolyl-

N-4-异噁唑乙酰胺置于palladium On Activated Charcoal Sodium Hydroxide,氢气体系中,用乙醇用作溶剂,化学反应 1.0H,反应生成2-甲基咪唑-4-甲醛
参考文献:Synthesis Of 4(5)-Acyl-,1-Substituted 5-Acyl-And 1-Substituted 4-Acyl-1H-Imidazoles From 4-Aminoisoxazoles
标题:Synthesis Of 4(5)-Acyl-,1-Substituted 5-Acyl-And 1-Substituted 4-Acyl-1H-Imidazoles From 4-Aminoisoxazoles
摘要:
Doi:10.1021/jo00389A015

海关参考信息

2912110000-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-10226449-B2
优先权日:2013-12-20
标题:Heterocyclic modulators of lipid synthesis and combinations thereof
发明人：HEUER TIMOTHY SEAN; OSLOB JOHAN D; MCDOWELL ROBERT S; JOHNSON RUSSELL; YANG HANBIAO; EVANCHIK MARC; ZAHARIA CRISTIANA A; CAI HAIYING; HU LILY W; DUKE GREGORY; OHOL-GUPTA YAMINI; O'FARRELL MARIE
权利人:3 V BIOSCIENCES INC
摘要:Heterocyclic modulators of lipid synthesis are provided as well as pharmaceutically acceptable salts thereof; pharmaceutical compositions comprising such compounds; and methods of treating conditions characterized by dysregulation of a fatty acid synthase pathway by the administration of such compounds and combinations of such compounds and other therapeutic agents.

专利号:US-9428502-B2
优先权日:2012-07-03
标题:Heterocyclic modulators of lipid synthesis
发明人：OSLOB JOHAN D; MCDOWELL ROBERT S; JOHNSON RUSSELL; YANG HANBIAO; EVANCHIK MARC; ZAHARIA CRISTIANA A; CAI HAIYING; HU LILY W; WAGMAN ALLAN S
权利人:3-V BIOSCIENCES INC
摘要:Heterocyclic modulators of lipid synthesis are provided as well as pharmaceutically acceptable salts thereof; pharmaceutical compositions comprising such compounds; and methods of treating conditions characterized by disregulation of a fatty acid synthase pathway by the administration of such compounds.

专利号:US-2018222892-A1
优先权日:2012-07-03
标题 :Heterocyclic modulators of lipid synthesis

专利号:EP-3083583-B1
优先权日:2013-12-20
标题:Heterocyclic modulators of lipid synthesis and combinations thereof

专利号:CA-2934251-A1
优先权日:2013-12-20
标题:A combination of heterocyclic modulators of lipid synthesis and chemotherapeutic drugs in treatment of cancer

专利号:EP-3083583-A1
优先权日:2013-12-20
标题 :Heterocyclic modulators of lipid synthesis and combinations thereof