Formula |
C8H6ClNO3S |
IUPAC Name |
cyanomethyl 4-chlorobenzenesulfonate |
Molecular Mass |
231.656 g·mol−1 |
Heat of Formation |
-295.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.48 ± 1.08 D |
Volume |
237.11 Å 3 |
Surface Area |
232.12 Å 2 |
HOMO Energy |
-10.61 ± 0.55 eV |
LUMO Energy |
-1.31 ± eV |
Point Group Symmetry |
Cs
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Synonyms
|
- 4-chlorobenzenesulfonic acid cyanomethyl ester
- 4-chlorobenzenesulfonylglycolic acid nitrile
- benzenesulfonic acid, 4-chloro-, cyanomethyl ester
- p-chlorobenzenesulfonylglycolic acid nitrile
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CAS Number(s) |
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InChIKey |
HUBNRULYPBPVCR-UHFFFAOYSA-N |
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Links |
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Downloads |
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Elements |
C
Cl
H
O
N
S
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