Home Nitriles 2,3-diamino-6-fluorobenzonitrile

2,3-diamino-6-fluorobenzonitrile

CAS No.:
1823877-26-4
Catalog Number:
AG01BV5L
Molecular Formula:
C7H6FN3
Molecular Weight:
151.1410
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Product Description
Catalog Number:
AG01BV5L
Chemical Name:
2,3-diamino-6-fluorobenzonitrile
CAS Number:
1823877-26-4
Molecular Formula:
C7H6FN3
Molecular Weight:
151.1410
MDL Number:
MFCD27975508
IUPAC Name:
2,3-diamino-6-fluorobenzonitrile
InChI:
InChI=1S/C7H6FN3/c8-5-1-2-6(10)7(11)4(5)3-9/h1-2H,10-11H2
InChI Key:
KPWNEHDUTNGHCR-UHFFFAOYSA-N
SMILES:
N#Cc1c(F)ccc(c1N)N
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.055g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
151.144g/mol
Monoisotopic Mass:
151.055g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties