Formula |
C6H12OS |
IUPAC Name |
s-methyl 3-methylbutanethioate |
Molecular Mass |
132.224 g·mol−1 |
Heat of Formation |
-266.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.10 ± 1.08 D |
Volume |
177.74 Å 3 |
Surface Area |
178.12 Å 2 |
HOMO Energy |
-9.13 ± 0.55 eV |
LUMO Energy |
2.59 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 3-methylbutanethioic acid s-methyl ester
- butanethioic acid, 3-methyl-, s-methyl ester
- methanethiol isovalerate
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CAS Number(s) |
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InChIKey |
MPLWTJZAFOVXKP-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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