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1823331-15-2 | 6H-Pyrrolo[2,3-b]pyrazin-6-one, 2-bromo-5,7-dihydro-
CAS No: 1823331-15-2 Catalog No: AG0023NK MDL No:MFCD26516288
Product Description
Catalog Number:
AG0023NK
Chemical Name:
6H-Pyrrolo[2,3-b]pyrazin-6-one, 2-bromo-5,7-dihydro-
CAS Number:
1823331-15-2
Molecular Formula:
C6H4BrN3O
Molecular Weight:
214.0195
MDL Number:
MFCD26516288
IUPAC Name:
2-bromo-5,7-dihydropyrrolo[2,3-b]pyrazin-6-one
InChI:
InChI=1S/C6H4BrN3O/c7-4-2-8-6-3(9-4)1-5(11)10-6/h2H,1H2,(H,8,10,11)
InChI Key:
REECXIWIQIVWRP-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1)nc(cn2)Br
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.954g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.022g/mol
Monoisotopic Mass:
212.954g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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