Home Halogens 1-bromo-5H,6H,7H,8H-imidazo[1,5-c]pyrimidin-5-one

1-bromo-5H,6H,7H,8H-imidazo[1,5-c]pyrimidin-5-one

CAS No.:
1783619-44-2
Catalog Number:
AG01C7DJ
Molecular Formula:
C6H6BrN3O
Molecular Weight:
216.0353
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Product Description
Catalog Number:
AG01C7DJ
Chemical Name:
1-bromo-5H,6H,7H,8H-imidazo[1,5-c]pyrimidin-5-one
CAS Number:
1783619-44-2
Molecular Formula:
C6H6BrN3O
Molecular Weight:
216.0353
MDL Number:
MFCD28530721
IUPAC Name:
1-bromo-7,8-dihydro-6H-imidazo[1,5-c]pyrimidin-5-one
InChI:
InChI=1S/C6H6BrN3O/c7-5-4-1-2-8-6(11)10(4)3-9-5/h3H,1-2H2,(H,8,11)
InChI Key:
RZMAWLZUQMYTJE-UHFFFAOYSA-N
SMILES:
Brc1ncn2c1CCNC2=O
Properties
Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.969g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.038g/mol
Monoisotopic Mass:
214.969g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties