Home Nitriles 5-Ethoxy-2-nitrobenzonitrile

5-Ethoxy-2-nitrobenzonitrile

CAS No.:
1415819-87-2
Catalog Number:
AG009WTN
Molecular Formula:
C9H8N2O3
Molecular Weight:
192.1714
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$100
- +
5g
96%
In Stock USA
United States
$300
- +
25g
96%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG009WTN
Chemical Name:
5-Ethoxy-2-nitrobenzonitrile
CAS Number:
1415819-87-2
Molecular Formula:
C9H8N2O3
Molecular Weight:
192.1714
MDL Number:
MFCD22586697
IUPAC Name:
5-ethoxy-2-nitrobenzonitrile
InChI:
InChI=1S/C9H8N2O3/c1-2-14-8-3-4-9(11(12)13)7(5-8)6-10/h3-5H,2H2,1H3
InChI Key:
FKHDQGBZQJRJNV-UHFFFAOYSA-N
SMILES:
CCOc1ccc(c(c1)C#N)[N+](=O)[O-]
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.053g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.174g/mol
Monoisotopic Mass:
192.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties