Formula |
C14H12N4O |
IUPAC Name |
4-(5-methyl-3-phenyl-isoxazol-4-yl)pyrimidin-2-amine |
Molecular Mass |
252.271 g·mol−1 |
Heat of Formation |
309.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.44 ± 1.08 D |
Volume |
299.4 Å 3 |
Surface Area |
265.63 Å 2 |
HOMO Energy |
-9.21 ± 0.55 eV |
LUMO Energy |
2.49 ± eV |
Point Group Symmetry |
C1
|
Synonyms
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- 4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)pyrimidin-2-amine
- 4-(5-methyl-3-phenyl-4-isoxazolyl)-2-pyrimidinamine
- [4-(5-methyl-3-phenyl-isoxazol-4-yl)pyrimidin-2-yl]amine
|
InChIKey |
XWMBSXFOZPVNQH-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
N
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