Home Nitriles 2,4-Difluoro-3-methoxybenzonitrile

2,4-Difluoro-3-methoxybenzonitrile

CAS No.:
220353-20-8
Catalog Number:
AG003JMM
Molecular Formula:
C8H5F2NO
Molecular Weight:
169.1282
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$75
- +
1g
96%
In Stock USA
United States
$188
- +
5g
96%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG003JMM
Chemical Name:
2,4-Difluoro-3-methoxybenzonitrile
CAS Number:
220353-20-8
Molecular Formula:
C8H5F2NO
Molecular Weight:
169.1282
MDL Number:
MFCD04115932
IUPAC Name:
2,4-difluoro-3-methoxybenzonitrile
InChI:
InChI=1S/C8H5F2NO/c1-12-8-6(9)3-2-5(4-11)7(8)10/h2-3H,1H3
InChI Key:
RWTCBZZFDKXOLX-UHFFFAOYSA-N
SMILES:
COc1c(F)ccc(c1F)C#N
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.034g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.131g/mol
Monoisotopic Mass:
169.034g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties