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Home Other Building Blocks 3-Iodoaniline

3-Iodoaniline

CAS No.:
626-01-7
Catalog Number:
AG0033QG
Molecular Formula:
C6H6IN
Molecular Weight:
219.0230
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
96%
In Stock USA
United States
$43
- +
100g
96%
In Stock USA
United States
$124
- +
500g
96%
In Stock USA
United States
$500
- +
Product Description
Catalog Number:
AG0033QG
Chemical Name:
3-Iodoaniline
CAS Number:
626-01-7
Molecular Formula:
C6H6IN
Molecular Weight:
219.0230
MDL Number:
MFCD00007781
IUPAC Name:
3-iodoaniline
InChI:
InChI=1S/C6H6IN/c7-5-2-1-3-6(8)4-5/h1-4H,8H2
InChI Key:
FFCSRWGYGMRBGD-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)I
EC Number:
210-922-7
NSC Number:
34545
Properties
Complexity:
74.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.954g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.025g/mol
Monoisotopic Mass:
218.954g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
(E)-1-[(3-Iodo-phen-yl)imino-meth-yl]naphthalen-2-ol. Acta crystallographica. Section E, Structure reports online 20121001
Application of ynamides in the synthesis of 2-amidoindoles. Organic letters 20090101
Radioiodination of humic substances via azocoupling with 3-[125I] iodoaniline. Environmental science & technology 20080601
Ionic-liquid-promoted palladium-catalyzed multicomponent cyclocarbonylation of o-iodoanilines and allenes to form methylene-2,3-dihydro-1H-quinolin-4-ones. The Journal of organic chemistry 20070427
3-iodoanilinium 2-carboxy-6-nitrobenzoate: a three-dimensional framework built from O-H...O and N-H...O hydrogen bonds and a two-centre iodo-nitro interaction. Acta crystallographica. Section C, Crystal structure communications 20050401
Concise synthesis of (+/-)-horsfiline and (+/-)-coerulescine by tandem cyclisation of iodoaryl alkenyl azides. Organic & biomolecular chemistry 20030107
Synthesis of novel alpha-C-glycosylamino acids and reverse regioselectivity in Larock's heteroannulation for the synthesis of the indole nucleus. Bioscience, biotechnology, and biochemistry 20021001
Properties