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Home Sulfos 2,4,5-Trichlorobenzenesulfonyl chloride

2,4,5-Trichlorobenzenesulfonyl chloride

CAS No.:
15945-07-0
Catalog Number:
AG001QPP
Molecular Formula:
C6H2Cl4O2S
Molecular Weight:
279.9559
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$13
- +
5g
95%
In Stock USA
United States
$19
- +
25g
95%
In Stock USA
United States
$50
- +
100g
95%
In Stock USA
United States
$150
- +
Product Description
Catalog Number:
AG001QPP
Chemical Name:
2,4,5-Trichlorobenzenesulfonyl chloride
CAS Number:
15945-07-0
Molecular Formula:
C6H2Cl4O2S
Molecular Weight:
279.9559
MDL Number:
MFCD00007428
IUPAC Name:
2,4,5-trichlorobenzenesulfonyl chloride
InChI:
InChI=1S/C6H2Cl4O2S/c7-3-1-5(9)6(2-4(3)8)13(10,11)12/h1-2H
InChI Key:
WNVVRCKTQSCPAC-UHFFFAOYSA-N
SMILES:
Clc1cc(c(cc1Cl)Cl)S(=O)(=O)Cl
EC Number:
240-079-0
UNII:
7GD5283XIX
NSC Number:
26958
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.85g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.94g/mol
Monoisotopic Mass:
277.853g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Literature
Title Journal
Experimental (FT-IR and FT-Raman) and theoretical (HF and DFT) investigation, NMR, NBO, electronic properties and frequency estimation analyses on 2,4,5-trichlorobenzene sulfonyl chloride. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20121101
Properties