Home Halogens 3,4-Dichloro-2,6-dinitrotoluene

3,4-Dichloro-2,6-dinitrotoluene

CAS No.:
53278-85-6
Catalog Number:
AG003IFX
Molecular Formula:
C7H4Cl2N2O4
Molecular Weight:
251.0237
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
25g
98%
In Stock USA
United States
$1200
- +
Product Description
Catalog Number:
AG003IFX
Chemical Name:
3,4-Dichloro-2,6-dinitrotoluene
CAS Number:
53278-85-6
Molecular Formula:
C7H4Cl2N2O4
Molecular Weight:
251.0237
MDL Number:
MFCD11855827
IUPAC Name:
1,2-dichloro-4-methyl-3,5-dinitrobenzene
InChI:
InChI=1S/C7H4Cl2N2O4/c1-3-5(10(12)13)2-4(8)6(9)7(3)11(14)15/h2H,1H3
InChI Key:
BIHKGLGGTMRFRS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(Cl)c(c(c1C)[N+](=O)[O-])Cl
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.955g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.019g/mol
Monoisotopic Mass:
249.955g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties