Formula |
C5H6BrN3O |
IUPAC Name |
2-amino-5-bromo-6-methyl-1h-pyrimidin-4-one |
Molecular Mass |
204.025 g·mol−1 |
Heat of Formation |
-34.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.10 ± 1.08 D |
Volume |
172.97 Å 3 |
Surface Area |
174.34 Å 2 |
HOMO Energy |
-9.28 ± 0.55 eV |
LUMO Energy |
2.56 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-amino-5-bromo-4-hydroxy-6-methylpyrimidine
- 2-amino-5-bromo-6-methyl-1h-pyrimidin-4-one
- 2-amino-5-bromo-6-methyl-4(3h)-pyrimidinone
- 2-amino-5-bromo-6-methyl-4-pyrimidinol
- 2-amino-5-bromo-6-methylpyrimidin-4(1h)-one
- 5-bromo-6-methylisocytosine
- u 25166
- u-25166
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CAS Number(s) |
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InChIKey |
ADLWOFHKMXUDKF-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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|
Elements |
H
C
O
Br
N
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