Formula |
C21H19NO3 |
IUPAC Name |
8-methoxy-5-[[methyl(prop-2-ynyl)amino]methyl]-3-phenyl-chromen-2-one |
Molecular Mass |
333.380 g·mol−1 |
Heat of Formation |
55.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.59 ± 1.08 D |
Volume |
403.75 Å 3 |
Surface Area |
352.48 Å 2 |
HOMO Energy |
-8.81 ± 0.55 eV |
LUMO Energy |
-0.93 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 2h-1-benzopyran-2-one, 8-methoxy-5-((methyl-2-propynylamino)methyl)-3-phenyl-
- 8-methoxy-3-phenyl-5-methylpropargylaminomethyl-1,2-benzopyrone
- 8-methoxy-5-[(methyl-prop-2-ynyl-amino)methyl]-3-phenyl-chromen-2-one
- 8-methoxy-5-[(methyl-prop-2-ynylamino)methyl]-3-phenyl-2-chromenone
- 8-methoxy-5-[(methyl-prop-2-ynylamino)methyl]-3-phenylchromen-2-one
- 8-methoxy-5-[(methyl-propargyl-amino)methyl]-3-phenyl-coumarin
- fr 54
- pargyropiranone
- pargyropyranone
|
CAS Number(s) |
|
InChIKey |
DAOPKAGAUIPYPR-UHFFFAOYSA-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
|
|
|