Home Nitriles 4,5-Dimethoxy-2-fluorobenzonitrile

4,5-Dimethoxy-2-fluorobenzonitrile

CAS No.:
119396-88-2
Catalog Number:
AG000IOK
Molecular Formula:
C9H8FNO2
Molecular Weight:
181.1637
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$38
- +
5g
98%
In Stock USA
United States
$90
- +
10g
98%
In Stock USA
United States
$144
- +
25g
98%
In Stock USA
United States
$282
- +
100g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG000IOK
Chemical Name:
4,5-Dimethoxy-2-fluorobenzonitrile
CAS Number:
119396-88-2
Molecular Formula:
C9H8FNO2
Molecular Weight:
181.1637
MDL Number:
MFCD00143236
IUPAC Name:
2-fluoro-4,5-dimethoxybenzonitrile
InChI:
InChI=1S/C9H8FNO2/c1-12-8-3-6(5-11)7(10)4-9(8)13-2/h3-4H,1-2H3
InChI Key:
QZKGCLSVCWWARO-UHFFFAOYSA-N
SMILES:
COc1cc(C#N)c(cc1OC)F
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.054g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.166g/mol
Monoisotopic Mass:
181.054g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties