Formula |
C10H10O3 |
IUPAC Name |
(3s)-8-hydroxy-3-methyl-isochroman-1-one |
Molecular Mass |
178.185 g·mol−1 |
Heat of Formation |
-455.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.43 ± 1.08 D |
Volume |
204.28 Å 3 |
Surface Area |
198.13 Å 2 |
HOMO Energy |
-9.56 ± 0.55 eV |
LUMO Energy |
-0.63 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (3s)-8-hydroxy-3-methyl-1-isochromanone
- (3s)-8-hydroxy-3-methyl-isochroman-1-one
- (3s)-8-hydroxy-3-methylisochroman-1-one
|
InChIKey |
KWILGNNWGSNMPA-LURJTMIESA-N |
QR Code |
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Links |
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|
DOI |
|
Downloads |
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|
Elements |
H
C
O
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