Formula |
C9H14N2O |
IUPAC Name |
3-methyl-5-[(2s)-1-methylpyrrolidin-2-yl]isoxazole |
Molecular Mass |
166.220 g·mol−1 |
Heat of Formation |
38.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.68 ± 1.08 D |
Volume |
215.23 Å 3 |
Surface Area |
205.93 Å 2 |
HOMO Energy |
-9.25 ± 0.55 eV |
LUMO Energy |
3.38 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 3-methyl-5-[(2s)-1-methyl-2-pyrrolidinyl]isoxazole
- 3-methyl-5-[(2s)-1-methylpyrrolidin-2-yl]-1,2-oxazole
- 3-methyl-5-[(2s)-1-methylpyrrolidin-2-yl]isoxazole
- abt 418
- abt-418
- isoxazole, 3-methyl-5-((2s)-1-methyl-2-pyrrolidinyl)-
- isoxazole, 3-methyl-5-(1-methyl-2-pyrrolidinyl)-, (s)-
|
CAS Number(s) |
|
InChIKey |
ILLGYRJAYAAAEW-QMMMGPOBSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
Wikipedia
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
O
N
|
|
|