Home Halogens 1-chloro-2-(chloromethyl)-4-nitrobenzene

1-chloro-2-(chloromethyl)-4-nitrobenzene

CAS No.:
69422-57-7
Catalog Number:
AG01AI9K
Molecular Formula:
C7H5Cl2NO2
Molecular Weight:
206.0261
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Product Description
Catalog Number:
AG01AI9K
Chemical Name:
1-chloro-2-(chloromethyl)-4-nitrobenzene
CAS Number:
69422-57-7
Molecular Formula:
C7H5Cl2NO2
Molecular Weight:
206.0261
MDL Number:
MFCD12025223
IUPAC Name:
1-chloro-2-(chloromethyl)-4-nitrobenzene
InChI:
InChI=1S/C7H5Cl2NO2/c8-4-5-3-6(10(11)12)1-2-7(5)9/h1-3H,4H2
InChI Key:
HORIWLYGDAZMKL-UHFFFAOYSA-N
SMILES:
ClCc1cc(ccc1Cl)[N+](=O)[O-]
NSC Number:
145030
Properties
Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.97g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.022g/mol
Monoisotopic Mass:
204.97g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties