Formula |
C8H10O4S |
IUPAC Name |
o-tolylmethyl hydrogen sulfate |
Molecular Mass |
202.228 g·mol−1 |
Heat of Formation |
-643.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.57 ± 1.08 D |
Volume |
220.35 Å 3 |
Surface Area |
212.46 Å 2 |
HOMO Energy |
-9.63 ± 0.55 eV |
LUMO Energy |
-0.44 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (2-methylbenzyl) hydrogen sulfate
- (2-methylphenyl)methyl hydrogen sulfate
- 2-methylbenzylsulfate
- benzenemethanol, 2-methyl-, hydrogen sulfate
- o-methylbenzylsulfate
- ortho-methylbenzyl sulfate
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CAS Number(s) |
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InChIKey |
AUKMJEJKSWPQNL-UHFFFAOYSA-N |
QR Code |
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Links |
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|
DOI |
|
Downloads |
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|
Elements |
H
S
C
O
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