Formula |
C13H17NO5 |
IUPAC Name |
[2-[1-[(2r)-2-acetoxypropyl]pyrrol-2-yl]-2-oxo-ethyl] acetate |
Molecular Mass |
267.278 g·mol−1 |
Heat of Formation |
-837.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.46 ± 1.08 D |
Volume |
319.37 Å 3 |
Surface Area |
291.29 Å 2 |
HOMO Energy |
-9.33 ± 0.55 eV |
LUMO Energy |
-0.18 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- [(1r)-2-[2-(2-acetoxyacetyl)pyrrol-1-yl]-1-methyl-ethyl] acetate
- [(2r)-1-[2-(2-acetyloxyacetyl)pyrrol-1-yl]propan-2-yl] acetate
- [(2r)-1-[2-(2-acetyloxyethanoyl)pyrrol-1-yl]propan-2-yl] ethanoate
- acetic acid [(1r)-2-[2-(2-acetoxy-1-oxoethyl)-1-pyrrolyl]-1-methylethyl] ester
- acetic acid [(1r)-2-[2-(2-acetoxyacetyl)pyrrol-1-yl]-1-methyl-ethyl] ester
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InChIKey |
JAKDZKXSEXYEJR-SECBINFHSA-N |
QR Code |
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Links |
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Elements |
H
C
O
N
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