Home Nitriles 5-Methoxy-2-nitrobenzonitrile

5-Methoxy-2-nitrobenzonitrile

CAS No.:
38469-84-0
Catalog Number:
AG00BYK6
Molecular Formula:
C8H6N2O3
Molecular Weight:
178.1448
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$19
- +
5g
98%
In Stock USA
United States
$75
- +
10g
98%
In Stock USA
United States
$113
- +
25g
98%
In Stock USA
United States
$225
- +
100g
98%
In Stock USA
United States
$725
- +
Product Description
Catalog Number:
AG00BYK6
Chemical Name:
5-Methoxy-2-nitrobenzonitrile
CAS Number:
38469-84-0
Molecular Formula:
C8H6N2O3
Molecular Weight:
178.1448
MDL Number:
MFCD09056823
IUPAC Name:
5-methoxy-2-nitrobenzonitrile
InChI:
InChI=1S/C8H6N2O3/c1-13-7-2-3-8(10(11)12)6(4-7)5-9/h2-4H,1H3
InChI Key:
GCXTYFJQZDWUNU-UHFFFAOYSA-N
SMILES:
N#Cc1cc(OC)ccc1[N+](=O)[O-]
NSC Number:
263768
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.038g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.147g/mol
Monoisotopic Mass:
178.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties