Home Nitriles 2-Nitrobenzonitrile

2-Nitrobenzonitrile

CAS No.:
612-24-8
Catalog Number:
AG003HSH
Molecular Formula:
C7H4N2O2
Molecular Weight:
148.1189
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$58
- +
25g
95%
In Stock USA
United States
$130
- +
100g
95%
In Stock USA
United States
$410
- +
Product Description
Catalog Number:
AG003HSH
Chemical Name:
2-Nitrobenzonitrile
CAS Number:
612-24-8
Molecular Formula:
C7H4N2O2
Molecular Weight:
148.1189
MDL Number:
MFCD00007044
IUPAC Name:
2-nitrobenzonitrile
InChI:
InChI=1S/C7H4N2O2/c8-5-6-3-1-2-4-7(6)9(10)11/h1-4H
InChI Key:
SWBDKCMOLSUXRH-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1[N+](=O)[O-]
EC Number:
210-301-0
UNII:
DRC6U29FCI
NSC Number:
1994
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.027g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.121g/mol
Monoisotopic Mass:
148.027g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties