Home Nitriles 4-Iodo-3-nitrobenzonitrile

4-Iodo-3-nitrobenzonitrile

CAS No.:
101420-79-5
Catalog Number:
AG0004H2
Molecular Formula:
C7H3IN2O2
Molecular Weight:
274.0154
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$166
- +
5g
95%
1 week
United States
$423
- +
10g
95%
1 week
United States
$616
- +
Product Description
Catalog Number:
AG0004H2
Chemical Name:
4-Iodo-3-nitrobenzonitrile
CAS Number:
101420-79-5
Molecular Formula:
C7H3IN2O2
Molecular Weight:
274.0154
MDL Number:
MFCD07783655
IUPAC Name:
4-iodo-3-nitrobenzonitrile
InChI:
InChI=1S/C7H3IN2O2/c8-6-2-1-5(4-9)3-7(6)10(11)12/h1-3H
InChI Key:
PZAMZPVQVFOYHP-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1)[N+](=O)[O-])I
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.924g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.017g/mol
Monoisotopic Mass:
273.924g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties