Home Nitriles 2-Iodoacetonitrile

2-Iodoacetonitrile

CAS No.:
624-75-9
Catalog Number:
AG003R0O
Molecular Formula:
C2H2IN
Molecular Weight:
166.9485
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
1 week
United States
$28
- +
5g
96%
1 week
United States
$48
- +
10g
96%
1 week
United States
$81
- +
Product Description
Catalog Number:
AG003R0O
Chemical Name:
2-Iodoacetonitrile
CAS Number:
624-75-9
Molecular Formula:
C2H2IN
Molecular Weight:
166.9485
MDL Number:
MFCD00001886
IUPAC Name:
2-iodoacetonitrile
InChI:
InChI=1S/C2H2IN/c3-1-2-4/h1H2
InChI Key:
VODKOOOHHCAWFR-UHFFFAOYSA-N
SMILES:
ICC#N
EC Number:
210-860-0
NSC Number:
81208
Properties
Complexity:
41.2  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.923g/mol
Formal Charge:
0
Heavy Atom Count:
4  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.949g/mol
Monoisotopic Mass:
166.923g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Literature
Title Journal
Occupational erythema multiforme-like contact reaction to iodoacetonitrile in a chemistry student. Contact dermatitis 20110301
Disturbances in the glutathione/ophthalmate redox buffer system in the woodchuck model of hepatitis virus-induced hepatocellular carcinoma. HPB surgery : a world journal of hepatic, pancreatic and biliary surgery 20110101
Intermolecular nonreductive alkylation of enamides via radical-polar crossover. Organic letters 20090219
Optimisation of chemical protein cleavage for erythropoietin semi-synthesis using native chemical ligation. Organic & biomolecular chemistry 20081107
Haloacetonitriles vs. regulated haloacetic acids: are nitrogen-containing DBPs more toxic? Environmental science & technology 20070115
Nonadiabatic dynamics in the photodissociation of ICH2CN at 266 and 304 nm studied by the velocity map imaging. The Journal of chemical physics 20060328
Oxidative addition of iodo-acetonitrile and of elemental halogens to [Pt3(mu-CO)3(PCy3)3]. Dalton transactions (Cambridge, England : 2003) 20050121
Properties