2-氨基-5-甲基噻吩-3-羧酸甲酯 | 19369-53-0
2-氨基-5-甲基噻吩-3-羧酸甲酯
Methyl 2-amino-5-methylthiophene-3-carboxylate
19369-53-0
C7H9NO2S
171.21686
名称和标识符
MDL |
MFCD01922101 |
InChIKey |
GHPDMFBHITXJAZ-UHFFFAOYSA-N |
Inchi |
InChI=1S/C7H9NO2S/c1-4-3-5(6(8)11-4)7(9)10-2/h3H,8H2,1-2H3 |
SMILES |
CC1=CC(=C(N)S1)C(=O)OC |
别名信息
- 中文别名 -
- 2-氨基-5-甲基噻吩-3-羧酸甲酯
- 2-氨基-5-甲基-噻吩-3-甲酸甲酯
- 英文别名 -
- Methyl 2-amino-5-methylthiophene-3-carboxylate
- 2-Amino-5-methyl-thiophene-3-carboxylic acid methyl ester
- 3-Thiophenecarboxylicacid, 2-amino-5-methyl-, methyl ester
- 2-Amino-5-Methyl-3-Thiophenecarboxylic Acid Methyl Ester
- methyl 2-amino-5-methyl3-thiophene-carboxylate
- methyl 2-amino-5-methyl-thiophene-3-carboxylate
- methyl 2-amino-5-methylthiophene-3-carboxylate(SALTDATA: FREE)
- 2-Amino-3-(methoxycarbonyl)-5-methylthiophene
- 2-Amino-5-methylthiophene-3-carboxylic acid methyl ester
- 12-AMINO-6-METHYLTHIOPHENE-3-CARBOXYLATE
- 2-amino-5-methyl-3-thiophenecarboxylic acid methyl ester
- 3-Thiophenecarboxylic acid, 2-aMino-5-Methyl-, Methyl ester
- methyl 2-amino-5-methylthiophene-3-carboxylate
- A18385
- SB10587
- EN300-227707
- J-012543
- AKOS000111622
- 3-Thiophenecarboxylic acid, 2-amino-5-methyl-, methyl ester
- methyl 2-amino-5-methyl-3-thiophene-carboxylate
- 19369-53-0
- AM803447
- MFCD01922101
- DTXSID90350228
- CS-0036595
- Methyl 2-amino-5-methylthiophene-3-carboxylate, AldrichCPR
- BB 0254724
- BCP03568
- SCHEMBL2181959
- methyl 2-amino-5-methyl-3-thiophenecarboxylate
- HMS1637K20
- methyl-2-amino-5-methyl-3-thiophenecarboxylate
- GHPDMFBHITXJAZ-UHFFFAOYSA-N
- Methyl 2-amino-5-methyl-thiophene-3-carboxylate
- CHEMBL4095885
- methyl2-amino-5-methylthiophene-3-carboxylate
- SY014209
- 2-AMINO-5-METHYL-THIOPHENE-3-CARBOXYLIC ACID METHYL ESTER
- FT-0678506
- F1751-0023
- methyl 2-amino-5-methylthiophene-3-carboxy-late
- FS-1358
物化性质
实验特性
LogP |
2.00650 |
PSA |
80.56000 |
沸点 |
278.2±35.0 ºC (760 Torr), |
闪点 |
122.0±25.9 ºC, |
溶解度 |
Very 微溶 (0.79 g/L) (25 ºC), |
密度 |
1.264±0.06 g/cm3 (20 ºC 760 Torr), |
计算特性
精确分子量 |
171.03500 |
氢键供体数量 |
1 |
氢键受体数量 |
3 |
可旋转化学键数量 |
2 |
同位素质量 |
171.03539970g/mol |
重原子数量 |
11 |
复杂度 |
163 |
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) |
2.1 |
拓扑分子极性表面积 |
80.6Ų |
海关数据
海关编码 |
2934999090 |
海关数据 |
中国海关编码:
2934999090
概述:
2934999090. 其他杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素:
品名, 成分含量, 用途
Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
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