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1333319-66-6

1333319-66-6 | 4-Pyrimidinamine, 6-bromo-2-chloro-

CAS No: 1333319-66-6 Catalog No: AG0014O9 MDL No:

Product Description

Catalog Number:
AG0014O9
Chemical Name:
4-Pyrimidinamine, 6-bromo-2-chloro-
CAS Number:
1333319-66-6
Molecular Formula:
C4H3BrClN3
Molecular Weight:
208.4437
IUPAC Name:
6-bromo-2-chloropyrimidin-4-amine
InChI:
InChI=1S/C4H3BrClN3/c5-2-1-3(7)9-4(6)8-2/h1H,(H2,7,8,9)
InChI Key:
GTUDVQHLUXUALJ-UHFFFAOYSA-N
SMILES:
Nc1cc(Br)nc(n1)Cl

Properties

Complexity:
102  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.92g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.443g/mol
Monoisotopic Mass:
206.92g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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