| Formula |
C7H9NO2 |
| IUPAC Name |
1-[3-(hydroxymethyl)-2h-pyrrol-1-ium-2-ylium-4-yl]ethanone |
| Molecular Mass |
139.152 g·mol−1 |
| Heat of Formation |
-286.7 ± 16.7 kJ·mol−1 |
| Dipole Moment |
7.18 ± 1.08 D |
| Volume |
166.36 Å 3 |
| Surface Area |
168.71 Å 2 |
| HOMO Energy |
-9.49 ± 0.55 eV |
| LUMO Energy |
2.87 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 1-(4-(hydroxymethyl)-1h-pyrrol-3-yl)ethanone
- 1-(4-methylol-1h-pyrrol-3-yl)ethanone
- 1-[4-(hydroxymethyl)-1h-pyrrol-3-yl]ethanone
- ethanone, 1-(4-(hydroxymethyl)-1h-pyrrol-3-yl)- (9ci)
- ethanone, 1-[4-(hydroxymethyl)-1h-pyrrol-3-yl]-
- verrucarin e
|
| CAS Number(s) |
|
| InChIKey |
ZCTFIKLDSSVBAL-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
O
N
|
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