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72754-05-3 | 6-Bromo-1,8-naphthyridin-2-ol
CAS No: 72754-05-3 Catalog No: AG003N3F MDL No:MFCD11226504
Product Description
Catalog Number:
AG003N3F
Chemical Name:
6-Bromo-1,8-naphthyridin-2-ol
CAS Number:
72754-05-3
Molecular Formula:
C8H5BrN2O
Molecular Weight:
225.0421
MDL Number:
MFCD11226504
IUPAC Name:
6-bromo-1H-1,8-naphthyridin-2-one
InChI:
InChI=1S/C8H5BrN2O/c9-6-3-5-1-2-7(12)11-8(5)10-4-6/h1-4H,(H,10,11,12)
InChI Key:
BCEWGGGNOQNYKK-UHFFFAOYSA-N
SMILES:
Brc1cnc2c(c1)ccc(n2)O
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.959g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.045g/mol
Monoisotopic Mass:
223.959g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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