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1000577-85-4

1000577-85-4 | 2-Amino-5-chloro-6-fluoro-3-iodobenzonitrile

CAS No: 1000577-85-4 Catalog No: AG01FAIU MDL No:MFCD09800814

Product Description

Catalog Number:
AG01FAIU
Chemical Name:
2-Amino-5-chloro-6-fluoro-3-iodobenzonitrile
CAS Number:
1000577-85-4
Molecular Formula:
C7H3ClFIN2
Molecular Weight:
296.4680
MDL Number:
MFCD09800814
IUPAC Name:
2-amino-5-chloro-6-fluoro-3-iodobenzonitrile
InChI:
InChI=1S/C7H3ClFIN2/c8-4-1-5(10)7(12)3(2-11)6(4)9/h1H,12H2
InChI Key:
SHKGZYTZNRSZAQ-UHFFFAOYSA-N
SMILES:
N#Cc1c(F)c(Cl)cc(c1N)I

Properties

Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.901g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
296.468g/mol
Monoisotopic Mass:
295.901g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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