Formula |
C8H16OS |
IUPAC Name |
s-isopropyl 3-methylbutanethioate |
Molecular Mass |
160.277 g·mol−1 |
Heat of Formation |
-321.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
0.71 ± 1.08 D |
Volume |
219.42 Å 3 |
Surface Area |
212.16 Å 2 |
HOMO Energy |
-9.11 ± 0.55 eV |
LUMO Energy |
2.62 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-methylbutanethioic acid s-isopropyl ester
- 3-methylthiobutyric acid, s-isopropyl ester
- butanethioic acid, 3-methyl-, s-(1-methylethyl) ester
- s-1-methylethyl 3-methylbutanethioate
- s-isopropyl 3-methylthiobutyrate
- s-propan-2-yl 3-methylbutanethioate
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CAS Number(s) |
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InChIKey |
KMXYCSRBFGUVHW-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
S
O
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