| Formula |
C6H9NO3 |
| IUPAC Name |
2-isocyanatoethyl propanoate |
| Molecular Mass |
143.141 g·mol−1 |
| Heat of Formation |
-502.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.40 ± 1.08 D |
| Volume |
176.82 Å 3 |
| Surface Area |
185.53 Å 2 |
| HOMO Energy |
-10.48 ± 0.55 eV |
| LUMO Energy |
0.35 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-isocyanatoethanol propanoate (ester)
- ethanol, 2-isocyanato-, propanoate (ester)
- propanoic acid 2-isocyanatoethyl ester
- propionic acid 2-isocyanatoethyl ester
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| CAS Number(s) |
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| InChIKey |
XORYIVGDQQWQCS-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
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| Downloads |
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|
| Elements |
H
C
O
N
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