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Home Nitros 2-Iodo-4-nitroaniline

2-Iodo-4-nitroaniline

CAS No.:
6293-83-0
Catalog Number:
AG00IB43
Molecular Formula:
C6H5IN2O2
Molecular Weight:
264.0206
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$22
- +
5g
98%
In Stock USA
United States
$69
- +
10g
98%
In Stock USA
United States
$113
- +
25g
98%
In Stock USA
United States
$138
- +
100g
95%
In Stock USA
United States
$457
- +
Product Description
Catalog Number:
AG00IB43
Chemical Name:
2-Iodo-4-nitroaniline
CAS Number:
6293-83-0
Molecular Formula:
C6H5IN2O2
Molecular Weight:
264.0206
MDL Number:
MFCD00955758
IUPAC Name:
2-iodo-4-nitroaniline
InChI:
InChI=1S/C6H5IN2O2/c7-5-3-4(9(10)11)1-2-6(5)8/h1-3H,8H2
InChI Key:
LOLSEMNGXKAZBZ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(c1)I)N
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.94g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
264.022g/mol
Monoisotopic Mass:
263.94g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
2-Bromo-4-nitro-aniline. Acta crystallographica. Section E, Structure reports online 20090301
Selective growth of a less stable polymorph of 2-iodo-4-nitroaniline on a self-assembled monolayer template. Chemical communications (Cambridge, England) 20041207
Triclinic and orthorhombic polymorphs of 2-iodo-4-nitroaniline: interplay of hydrogen bonds, nitro...I interactions and aromatic pi-pi-stacking interactions. Acta crystallographica. Section C, Crystal structure communications 20010801
Properties