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Home > Bromides > 1017789-07-9
1017789-07-9 | Pyrimidine, 5-bromo-2-(4-pyridinyloxy)-
CAS No: 1017789-07-9 Catalog No: AG0005J6 MDL No:
Product Description
Catalog Number:
AG0005J6
Chemical Name:
Pyrimidine, 5-bromo-2-(4-pyridinyloxy)-
CAS Number:
1017789-07-9
Molecular Formula:
C9H6BrN3O
Molecular Weight:
252.0674
IUPAC Name:
5-bromo-2-pyridin-4-yloxypyrimidine
InChI:
InChI=1S/C9H6BrN3O/c10-7-5-12-9(13-6-7)14-8-1-3-11-4-2-8/h1-6H
InChI Key:
RHULGZQGULVSMO-UHFFFAOYSA-N
SMILES:
Brc1cnc(nc1)Oc1ccncc1
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.969g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.071g/mol
Monoisotopic Mass:
250.969g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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