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3,4,5-三甲氧基苯甲醛 | 86-81-7

3,4,5-三甲氧基苯甲醛结构式图片|86-81-7结构式图片 →现货商城 点击进入
中文名称:3,4,5-三甲氧基苯甲醛
英文名称:3,4,5-Trimethoxybenzaldehyde
CAS No.:86-81-7 分子式:C10H12O4 分子量:196.1999
如需查看该化合物的详细结构式,mol文件,smile, InChi 请点击:3,4,5-三甲氧基苯甲醛结构式
MSDS:3,4,5-三甲氧基苯甲醛msds 价格行情:3,4,5-三甲氧基苯甲醛价格 PubChem CID:87576078
国内供应商
3,4,5-三甲氧基苯甲醛的其他展现形式
  • 相关化合物
香兰素 4-Hydroxy-3-methoxybenzaldehyde CAS No.:121-33-5
丁香醛 4-Hydroxy-3,5-dimethoxybenzaldehyde CAS No.:134-96-3
5-羟基香兰素 3,4-Dihydroxy-5-methoxybenzaldehyde CAS No.:3934-87-0
4-(2-甲氧基苯氧基)-苯甲醛 4-(2-Methoxy-phenoxy)-benzaldehyde CAS No.:78725-48-1
3,5-二甲氧基苯甲醛 3,5-Dimethoxybenzaldehyde CAS No.:7311-34-4
3,4-二甲氧基-5-羟基苯甲醛 3,4-Dimethoxy-5-hydroxybenzaldehyde CAS No.:29865-90-5
简介
3,4,5-Trimethoxybenzaldehyde 是合成各种药物的中间体,特别是用于研究细菌感染的甲氧苄啶的中间体 (intermediate),包括尿路病原体感染。
名称和标识符
MDL MFCD00003364
InChIKey OPHQOIGEOHXOGX-UHFFFAOYSA-N
Inchi 1S/C10H12O4/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-6H,1-3H3
SMILES O(C([H])([H])[H])C1C(=C([H])C(C([H])=O)=C([H])C=1OC([H])([H])[H])OC([H])([H])[H]
BRN 0395163
别名信息
- 中文别名 -
3,4,5-三甲氧基苯甲醛 3,4,5-Trimethoxybenzaldehyde 3,4,5-三甲氧基苯甲醛 3,4,5-三甲氧基苯甲醛 TMBA 三甲氧基苯甲醛
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- 英文别名 -
3,4,5-Trimethoxybenzaldehyde TMBA 3,4,5-Trimethoxybenzaldeh 3,4,5-Trimethoxybenz 3.4.5-Trimethoxyphenylaldehyde 3,4,5-(OMe)3-C6H2CHO 3,4,5-tri-(OMe)-PhCHO 3,4,5-tri-MeO-C6H2CHO 3,4,5-trimethoxy-benzaldehyde 3,4,5-tri-OMe-C6H3CHO BENZALDEHYDE,3,4,5-TRIMETHOXY EINECS 201-701-6 tri-o-methylgallaldehyde NSC 16692 Benzaldehyde, 3,4,5-trimethoxy- 3,4,5-trimethoxy benzaldehyde BENZALDEHYDE,3,4,5-TRIMETHOXY- WL86YD76N6 OPHQOIGEOHXOGX-UHFFFAOYSA-N NSC16692 PubChem8266 3,5-Trimethoxybenzaldehyde 3,4,5 trimethoxybenzaldehyde KSC490M1D 3,4,5 -trimethoxybenzaldehy W-104057 Q15634093 3,4,5,-trimethoxy benzaldehyde FT-0675585 3,4,5-Trimethoxybenzaldehyde, purum, >=98.0% (HPLC) 3, 4, 5-trimethoxy-benzaldehyde CHEMBL3577781 BBL007764 3,4,5-trimethoxybenzaldehyd SCHEMBL96635 AC-11732 Trimethoprim Intermediates Z104472688 T0059 BRN 0395163 NSC-16692 PD002060 A841837 86-81-7 3,4,5 -trimethoxybenzaldehyde STK498479 F3099-6595 CCG-231504 EN300-19082 3, 4, 5-trimethoxybenzaldehyde BCP30525 4-08-00-02719 (Beilstein Handbook Reference) LS-25170 MFCD00003364 SY010811 STR03224 3,4,5-Trimethoxybenzoic Acid,(S) DTXSID4058948 AKOS000118928 FT-0614154 InChI=1/C10H12O4/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-6H,1-3H UNII-WL86YD76N6 NSC778227 3,4,5,-trimethoxybenzaldehyde AI3-36673 3,4,5-Trimethoxybenzaldehyde, 98% HY-W009886 FT-0675584 NSC-778227 AC7996 CS-W010602 3,4,5-TRIMETHOXYBENZALDEHYDE CS-T-45540
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物化性质
 实验特性
LogP 1.52490
PSA 44.76000
折射率 1.5550 (estimate)
水溶性 微溶
沸点 165°C/10mmHg(lit.)
熔点 75.0 to 78.0 deg-C
闪点 163-165℃/10mm
溶解度 methanol: 0.1 g/mL, clear
颜色与性状 白色至微黄色针状晶体
敏感性 Air Sensitive
密度 1.2166 (rough estimate)
 计算特性
精确分子量 196.07400
氢键供体数量 0
氢键受体数量 4
可旋转化学键数量 4
同位素质量 196.073559
重原子数量 14
复杂度 169
同位素原子数量 0
确定原子立构中心数量 0
不确定原子立构中心数量 0
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 1
疏水参数计算参考值(XlogP) 0.9
互变异构体数量
表面电荷 0
拓扑分子极性表面积 44.8
国际标准相关数据
EINECS 16692
海关数据
海关编码 29124900
海关数据

中国海关编码:

2912499000

概述:

2912499000. 其他醛醚、醛酚及含其他含氧基的醛. 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, 四聚甲醛报明外观

Summary:

2912499000. other aldehyde-ethers, aldehyde-phenols and aldehydes with other oxygen function. VAT:17.0%. Tax rebate rate:9.0%. . MFN tariff:5.5%. General tariff:30.0%

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专业数据库参考
PubChemId 87576078
参考资料
Reaxys RN 395163
Beilstein 8,391
产品用途
用于合成抗菌增效药甲氧苄氨嘧啶
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