Home Halogens 2-amino-3-chloro-5-fluorobenzonitrile

2-amino-3-chloro-5-fluorobenzonitrile

CAS No.:
1263277-06-0
Catalog Number:
AG009J80
Molecular Formula:
C7H4ClFN2
Molecular Weight:
170.5715
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Product Description
Catalog Number:
AG009J80
Chemical Name:
2-amino-3-chloro-5-fluorobenzonitrile
CAS Number:
1263277-06-0
Molecular Formula:
C7H4ClFN2
Molecular Weight:
170.5715
MDL Number:
MFCD18426017
IUPAC Name:
2-amino-3-chloro-5-fluorobenzonitrile
InChI:
InChI=1S/C7H4ClFN2/c8-6-2-5(9)1-4(3-10)7(6)11/h1-2H,11H2
InChI Key:
XNQCLYHYYQRXNO-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)cc(c1N)Cl
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.005g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.571g/mol
Monoisotopic Mass:
170.005g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties