151408
4-Methyl-3-nitrobenzoic acid
99%
Synonym(s):
3-Nitro-p-toluic acid
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About This Item
Linear Formula:
CH3C6H3(NO2)CO2H
CAS Number:
Molecular Weight:
181.15
Beilstein:
1874411
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Assay
99%
form
solid
mp
187-190 °C (lit.)
SMILES string
Cc1ccc(cc1[N+]([O-])=O)C(O)=O
InChI
1S/C8H7NO4/c1-5-2-3-6(8(10)11)4-7(5)9(12)13/h2-4H,1H3,(H,10,11)
InChI key
BBEWSMNRCUXQRF-UHFFFAOYSA-N
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Application
4-Methyl-3-nitrobenzoic acid was used in the synthesis of one-dimensional (1D) lanthanide coordination complexes.
Storage Class Code
11 - Combustible Solids
WGK
WGK 1
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Certificates of Analysis (COA)
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Jumei Tian et al.
Dalton transactions (Cambridge, England : 2003), 42(23), 8504-8511 (2013-05-01)
Three novel one-dimensional (1D) lanthanide coordination complexes involving the 4-methyl-3-nitrobenzoic acid (HL) ligand, with the general formulae [Gd(L)3(H2O)(CH3OH)] (1), [Gd(L)3(H2O)2]·(4,4'-bpy)·CH3OH (2), [Dy(L)3(H2O)(CH3OH)] (3), have been synthesized by solvothermal reactions. These complexes have been structurally characterized by single-crystal X-ray diffraction, IR
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