Home Nitriles 4,5-Difluoro-2-methylbenzonitrile

4,5-Difluoro-2-methylbenzonitrile

CAS No.:
1003708-82-4
Catalog Number:
AG0001S9
Molecular Formula:
C8H5F2N
Molecular Weight:
153.1288
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>95%
In Stock USA
United States
$58
- +
Product Description
Catalog Number:
AG0001S9
Chemical Name:
4,5-Difluoro-2-methylbenzonitrile
CAS Number:
1003708-82-4
Molecular Formula:
C8H5F2N
Molecular Weight:
153.1288
MDL Number:
MFCD12910488
IUPAC Name:
4,5-difluoro-2-methylbenzonitrile
InChI:
InChI=1S/C8H5F2N/c1-5-2-7(9)8(10)3-6(5)4-11/h2-3H,1H3
InChI Key:
NEUWJWYFYDQUMY-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)c(cc1C)F
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.039g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.132g/mol
Monoisotopic Mass:
153.039g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties