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关于此项目
线性分子式:
CH3OC6H3(NO2)CHO
化学文摘社编号:
分子量:
181.15
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
97%
assay
97%
mp
97-100 °C (lit.)
functional group
aldehyde, nitro
SMILES string
COc1ccc(C=O)cc1[N+]([O-])=O
InChI
1S/C8H7NO4/c1-13-8-3-2-6(5-10)4-7(8)9(11)12/h2-5H,1H3
InChI key
YTCRQCGRYCKYNO-UHFFFAOYSA-N
存储类别
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
Tele nucleophilic aromatic substitutions in 1-nitro-3-and 1, 3-dinitro-5-trichloromethylbenzene, and 3-trichloromethylbenzonitrile. A new synthesis of the 1, 4-benzothiazine-3 (4H)-one ring system from 3-nitrobenzoic acid.
Giannopoulos T, et al.
Tetrahedron, 56(3), 447-453 (2000)
Synthesis, cytotoxic activity and docking studies of new 4-aza-podophyllotoxin derivatives.
Hatti I, et al.
Medicinal Chemistry Research, 24(8), 3305-3313 (2015)
Joshua R Ring et al.
Acta crystallographica. Section C, Crystal structure communications, 63(Pt 7), o392-o394 (2007-07-05)
In the title compound, C(9)H(12)N(5)O(3)(+) x Cl(-), the cation is almost entirely planar. The imine double bond is exclusively in the E geometry.
全球贸易项目编号
| 货号 | GTIN |
|---|---|
| 516422-5G | 04061831830095 |