Home Nitriles 3,5-Diiodo-4-methoxybenzonitrile

3,5-Diiodo-4-methoxybenzonitrile

CAS No.:
3336-40-1
Catalog Number:
AG00BZMZ
Molecular Formula:
C8H5I2NO
Molecular Weight:
384.9403
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
98%
In Stock USA
United States
$94
- +
250mg
98%
In Stock USA
United States
$150
- +
1g
98%
In Stock USA
United States
$375
- +
5g
98%
In Stock USA
United States
$1125
- +
Product Description
Catalog Number:
AG00BZMZ
Chemical Name:
3,5-Diiodo-4-methoxybenzonitrile
CAS Number:
3336-40-1
Molecular Formula:
C8H5I2NO
Molecular Weight:
384.9403
MDL Number:
MFCD00144497
IUPAC Name:
3,5-diiodo-4-methoxybenzonitrile
InChI:
InChI=1S/C8H5I2NO/c1-12-8-6(9)2-5(4-11)3-7(8)10/h2-3H,1H3
InChI Key:
LDZMXYUHLHAQAY-UHFFFAOYSA-N
SMILES:
COc1c(I)cc(cc1I)C#N
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.846g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
384.943g/mol
Monoisotopic Mass:
384.846g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties