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About This Item
Linear Formula:
Cl2C6H2(F)NO2
CAS Number:
Molecular Weight:
209.99
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Recommended Products
Assay
95%
refractive index
n20/D 1.575 (lit.)
bp
247 °C (lit.)
mp
17 °C (lit.)
density
1.596 g/mL at 25 °C (lit.)
functional group
chloro
fluoro
nitro
SMILES string
[O-][N+](=O)c1cc(Cl)c(Cl)cc1F
InChI
1S/C6H2Cl2FNO2/c7-3-1-5(9)6(10(11)12)2-4(3)8/h1-2H
InChI key
FXOCDIKCKFOUDE-UHFFFAOYSA-N
General description
Proton-detected local field (PDLF) spectra of 1,2-dichloro-4-fluoro-5-nitrobenzene in nematic solvents has been studied.
Application
1,2-Dichloro-4-fluoro-5-nitrobenzene may be used in the combinatorial solid-phase synthesis of bis-heterocyclic compounds. It was employed as solute to investigate the possibility of selective excitation in coupled multispin systems.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
10 - Combustible liquids
WGK
WGK 3
Flash Point(F)
235.4 °F - closed cup
Flash Point(C)
113 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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Miroslav Soural et al.
Journal of combinatorial chemistry, 10(6), 923-933 (2008-09-25)
Combinatorial solid-phase synthesis of bis-heterocyclic compounds, characterized by the presence of two heterocyclic cores connected by a spacer of variable length/structure, provided structurally heterogeneous libraries with skeletal diversity. Both heterocyclic rings were assembled on resin in a combinatorial fashion.
Selective excitation in dipole coupled systems.
Walls JD, et al.
Chemical Physics Letters, 357(3), 241-248 (2002)
Measurement of dipolar couplings in partially oriented molecules by local field NMR spectroscopy with low-power decoupling.
Marjanska M, et al.
Journal of Magnetic Resonance, 158(1), 52-59 (2002)
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