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Home > Bromides > 1240621-87-7
1240621-87-7 | 5-Pyrimidinol, 2-bromo-
CAS No: 1240621-87-7 Catalog No: AG000LIO MDL No:MFCD09953508
Product Description
Catalog Number:
AG000LIO
Chemical Name:
5-Pyrimidinol, 2-bromo-
CAS Number:
1240621-87-7
Molecular Formula:
C4H3BrN2O
Molecular Weight:
174.9834
MDL Number:
MFCD09953508
IUPAC Name:
2-bromopyrimidin-5-ol
InChI:
InChI=1S/C4H3BrN2O/c5-4-6-1-3(8)2-7-4/h1-2,8H
InChI Key:
QHUDDDWGZQPDIC-UHFFFAOYSA-N
SMILES:
Oc1cnc(nc1)Br
Properties
Complexity:
72.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.943g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.985g/mol
Monoisotopic Mass:
173.943g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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