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879-39-0 | 2,3,4,5-Tetrachloronitrobenzene , 98%
CAS No: 879-39-0 Catalog No: AG003FDE MDL No:MFCD00007064
Product Description
Catalog Number:
AG003FDE
Chemical Name:
2,3,4,5-Tetrachloronitrobenzene , 98%
CAS Number:
879-39-0
MDL Number:
MFCD00007064
IUPAC Name:
1,2,3,4-tetrachloro-5-nitrobenzene
InChI:
InChI=1S/C6HCl4NO2/c7-2-1-3(11(12)13)5(9)6(10)4(2)8/h1H
InChI Key:
MTBYTWZDRVOMBR-UHFFFAOYSA-N
EC Number:
212-906-5
UNII:
N2WU0K04EH
UN Number:
2811
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.873g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.879g/mol
Monoisotopic Mass:
258.876g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
Literature
| Title | Journal |
|---|---|
| Molecular structure, vibrational spectra, HOMO, LUMO and NMR studies of 1,2-dichloro-4-nitrobenzene and 2,3,5,6-tetrachloro-1-nitrobenzene based on density functional calculations. | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20120201 |
| Permeation of tecnazene through human skin in vitro as assessed by HS-SPME and GC-MS. | Environmental science & technology 20080901 |
| Residues of 18 organochlorine pesticides in 30 traditional Chinese medicines. | Chemosphere 20080401 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
| Increased scratching counts depend on a decrease in ability of cutaneous prostaglandin D2 biosynthesis in NC/Nga mice with atopic dermatitis. | Experimental dermatology 20051201 |
| Scratching behavior in spontaneous- or allergic contact-induced dermatitis in NC/Nga mice. | Experimental dermatology 20051101 |
| Studies on TMPD:TCNB; a donor-acceptor with room temperature paramagnetism and n-pi interaction. | Molecules (Basel, Switzerland) 20040831 |
| Ion chromatographic determination of the decomposition products of tecnazene solution irradiated by ultraviolet light: inorganic and organic anions. | Journal of agricultural and food chemistry 20010601 |
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