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823-89-2 | 5-Bromo-2-hydrazinopyrimidine
CAS No: 823-89-2 Catalog No: AG004WZM MDL No:MFCD03452780
Product Description
Catalog Number:
AG004WZM
Chemical Name:
5-Bromo-2-hydrazinopyrimidine
CAS Number:
823-89-2
Molecular Formula:
C4H5BrN4
Molecular Weight:
189.0133
MDL Number:
MFCD03452780
IUPAC Name:
(5-bromopyrimidin-2-yl)hydrazine
InChI:
InChI=1S/C4H5BrN4/c5-3-1-7-4(9-6)8-2-3/h1-2H,6H2,(H,7,8,9)
InChI Key:
JUOYVELUZXXEGE-UHFFFAOYSA-N
SMILES:
NNc1ncc(cn1)Br
Properties
Complexity:
80.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.97g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
189.016g/mol
Monoisotopic Mass:
187.97g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Literature
| Title | Journal |
|---|---|
| 4-Meth-oxy-benzaldehyde (5-bromo-pyrimidin-2-yl)hydrazone monohydrate. | Acta crystallographica. Section E, Structure reports online 20100901 |
| 5-Bromo-2-[5-(4-nitro-phen-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]pyrimidine. | Acta crystallographica. Section E, Structure reports online 20091201 |
| 4-(4-Bromo-phenyl-hydrazono)-1-(5-bromo-pyrimidin-2-yl)-3-methyl-2-pyrazolin-5-one. | Acta crystallographica. Section E, Structure reports online 20080201 |
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