2-{(2S)-2-Hydroxy-3-[(2-Methyl-2-Propanyl)Amino]Propoxy}Benzonitrile
Properties
Property | Value |
---|---|
Formula | C14H20N2O2 |
IUPAC Name | 2-[(2s)-3-(tert-butylamino)-2-hydroxy-propoxy]benzonitrile |
Molecular Mass | 248.321 g·mol−1 |
Heat of Formation | -232.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.52 ± 1.08 D |
Volume | 326.2 Å 3 |
Surface Area | 277.64 Å 2 |
HOMO Energy | -9.04 ± 0.55 eV |
LUMO Energy | -0.84 ± eV |
Point Group Symmetry | C1 |
InChIKey | VCVQSRCYSKKPBA-LBPRGKRZSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |