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About This Item
线性分子式:
CH3C6H3(NO2)CO2CH3
CAS Number:
分子量:
195.17
Beilstein:
1964020
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22
质量水平
方案
97%
表单
solid
mp
62-65 °C (lit.)
官能团
ester
nitro
SMILES字符串
COC(=O)c1cccc(c1C)[N+]([O-])=O
InChI
1S/C9H9NO4/c1-6-7(9(11)14-2)4-3-5-8(6)10(12)13/h3-5H,1-2H3
InChI key
CRZGFIMLHZTLGT-UHFFFAOYSA-N
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应用
Methyl 2-methyl-3-nitrobenzoate may be used in the synthesis of:
- methyl indole-4-carboxylate
- 5-aminoisoquinolin-1(2H)-one
- 5-nitroisocoumarin
- substituted nitrostyrene benzoic acids, via reaction with aromatic aldehydes in the presence of DBU in DMSO
- 4-(hydroxymethyl)-1-tosylindole, via Batcho-Leimgruber modification of the Reissert indole synthesis
- [2-(4-fluorophenyl)-1H-indol-4-yl]-1-pyrrolidinylmethanone
储存分类代码
11 - Combustible Solids
WGK
WGK 3
闪点(°F)
Not applicable
闪点(°C)
Not applicable
个人防护装备
Eyeshields, Gloves, type N95 (US)
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