Formula |
C12H24O2 |
IUPAC Name |
isohexyl 2,2-dimethylbutanoate |
Molecular Mass |
200.318 g·mol−1 |
Heat of Formation |
-605.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.23 ± 1.08 D |
Volume |
290.51 Å 3 |
Surface Area |
271.1 Å 2 |
HOMO Energy |
-10.40 ± 0.55 eV |
LUMO Energy |
0.97 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 2,2-dimethylbutanoic acid isohexyl ester
- 2,2-dimethylbutyric acid isohexyl ester
|
InChIKey |
WDPOYSSORRDLCQ-UHFFFAOYSA-N |
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Links |
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Elements |
H
C
O
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