Home Nitriles 3-Iodobenzonitrile

3-Iodobenzonitrile

CAS No.:
69113-59-3
Catalog Number:
AG003JLM
Molecular Formula:
C7H4IN
Molecular Weight:
229.0178
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
97%
In Stock USA
United States
$25
- +
25g
97%
In Stock USA
United States
$60
- +
100g
97%
In Stock USA
United States
$207
- +
500g
97%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG003JLM
Chemical Name:
3-Iodobenzonitrile
CAS Number:
69113-59-3
Molecular Formula:
C7H4IN
Molecular Weight:
229.0178
MDL Number:
MFCD00079762
IUPAC Name:
3-iodobenzonitrile
InChI:
InChI=1S/C7H4IN/c8-7-3-1-2-6(4-7)5-9/h1-4H
InChI Key:
BGARPMGQRREXLN-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)I
Properties
Complexity:
135  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.939g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.02g/mol
Monoisotopic Mass:
228.939g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties