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1260763-82-3 | 5-Pyrimidinol, 2-amino-4-bromo-
CAS No: 1260763-82-3 Catalog No: AG000R5Z MDL No:
Product Description
Catalog Number:
AG000R5Z
Chemical Name:
5-Pyrimidinol, 2-amino-4-bromo-
CAS Number:
1260763-82-3
Molecular Formula:
C4H4BrN3O
Molecular Weight:
189.9981
IUPAC Name:
2-amino-4-bromopyrimidin-5-ol
InChI:
InChI=1S/C4H4BrN3O/c5-3-2(9)1-7-4(6)8-3/h1,9H,(H2,6,7,8)
InChI Key:
LXRPVCGTYPEIIL-UHFFFAOYSA-N
SMILES:
Nc1ncc(c(n1)Br)O
Properties
Complexity:
102
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.954g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
190g/mol
Monoisotopic Mass:
188.954g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
72A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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