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Home Nitriles 2-Chloro-4-(3-fluoro-4-methylphenyl)benzonitrile

2-Chloro-4-(3-fluoro-4-methylphenyl)benzonitrile

CAS No.:
1355247-63-0
Catalog Number:
AG007ZJF
Molecular Formula:
C14H9ClFN
Molecular Weight:
245.6794
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG007ZJF
Chemical Name:
2-Chloro-4-(3-fluoro-4-methylphenyl)benzonitrile
CAS Number:
1355247-63-0
Molecular Formula:
C14H9ClFN
Molecular Weight:
245.6794
MDL Number:
MFCD21333013
IUPAC Name:
2-chloro-4-(3-fluoro-4-methylphenyl)benzonitrile
InChI:
InChI=1S/C14H9ClFN/c1-9-2-3-11(7-14(9)16)10-4-5-12(8-17)13(15)6-10/h2-7H,1H3
InChI Key:
IXGMTTMNUXFKLU-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1Cl)c1ccc(c(c1)F)C
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.041g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.681g/mol
Monoisotopic Mass:
245.041g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  
Properties