Home Halogens 2,4,5-Trichlorotoluene

2,4,5-Trichlorotoluene

CAS No.:
6639-30-1
Catalog Number:
AG00FAD6
Molecular Formula:
C7H5Cl3
Molecular Weight:
195.4736
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$438
- +
5g
95%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG00FAD6
Chemical Name:
2,4,5-Trichlorotoluene
CAS Number:
6639-30-1
Molecular Formula:
C7H5Cl3
Molecular Weight:
195.4736
MDL Number:
MFCD00044590
IUPAC Name:
1,2,4-trichloro-5-methylbenzene
InChI:
InChI=1S/C7H5Cl3/c1-4-2-6(9)7(10)3-5(4)8/h2-3H,1H3
InChI Key:
ZCXHZKNWIYVQNC-UHFFFAOYSA-N
SMILES:
Clc1cc(Cl)c(cc1C)Cl
EC Number:
229-644-2
UNII:
CN6GE686J2
NSC Number:
16047
Properties
Complexity:
115  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.946g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.467g/mol
Monoisotopic Mass:
193.946g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Literature
Title Journal
Rational engineering of the regioselectivity of TecA tetrachlorobenzene dioxygenase for the transformation of chlorinated toluenes. Microbiology (Reading, England) 20030401
The contribution of 2,3,5-trichlorophenyl methyl sulfone, a metabolite of 1,2,4-trichlorobenzene, to the delta-aminolevulinic acid synthetase induction by 1,2,4-trichlorobenzene in rat liver. Chemosphere 20020401
Properties