Home Nitriles 5-Chloro-2-nitrobenzonitrile

5-Chloro-2-nitrobenzonitrile

CAS No.:
34662-31-2
Catalog Number:
AG003MNM
Molecular Formula:
C7H3ClN2O2
Molecular Weight:
182.5639
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
In Stock USA
United States
$223
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Product Description
Catalog Number:
AG003MNM
Chemical Name:
5-Chloro-2-nitrobenzonitrile
CAS Number:
34662-31-2
Molecular Formula:
C7H3ClN2O2
Molecular Weight:
182.5639
MDL Number:
MFCD00007286
IUPAC Name:
5-chloro-2-nitrobenzonitrile
InChI:
InChI=1S/C7H3ClN2O2/c8-6-1-2-7(10(11)12)5(3-6)4-9/h1-3H
InChI Key:
HPWJUEZFOUOUEO-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Cl)ccc1[N+](=O)[O-]
EC Number:
252-132-5
NSC Number:
310024
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.988g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.563g/mol
Monoisotopic Mass:
181.988g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties