Home Nitros 1-Chloro-2-methyl-3,5-dinitrobenzene

1-Chloro-2-methyl-3,5-dinitrobenzene

CAS No.:
96-90-2
Catalog Number:
AG005SIR
Molecular Formula:
C7H5ClN2O4
Molecular Weight:
216.5786
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$250
- +
5g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG005SIR
Chemical Name:
1-Chloro-2-methyl-3,5-dinitrobenzene
CAS Number:
96-90-2
Molecular Formula:
C7H5ClN2O4
Molecular Weight:
216.5786
MDL Number:
MFCD00456399
IUPAC Name:
1-chloro-2-methyl-3,5-dinitrobenzene
InChI:
InChI=1S/C7H5ClN2O4/c1-4-6(8)2-5(9(11)12)3-7(4)10(13)14/h2-3H,1H3
InChI Key:
UECPDWARCDGMQV-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(Cl)c(c(c1)[N+](=O)[O-])C
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.994g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.577g/mol
Monoisotopic Mass:
215.994g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties