Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C10H13O6S.Na |
| Molecular Weight | 284.261 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].COC1=C(O)C=CC(CC(C)(O)S([O-])(=O)=O)=C1
InChI
InChIKey=KJFMQNRVLLRDGN-UHFFFAOYSA-M
InChI=1S/C10H14O6S.Na/c1-10(12,17(13,14)15)6-7-3-4-8(11)9(5-7)16-2;/h3-5,11-12H,6H2,1-2H3,(H,13,14,15);/q;+1/p-1
| Molecular Formula | C10H13O6S |
| Molecular Weight | 261.272 |
| Charge | -1 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
| Molecular Formula | Na |
| Molecular Weight | 22.98976928 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 18:26:58 GMT 2025
by
admin
on
Mon Mar 31 18:26:58 GMT 2025
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| Record UNII |
9Y3BCP9U7W
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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9Y3BCP9U7W
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25090836
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83682-27-3
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DTXSID701003676
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admin on Mon Mar 31 18:26:58 GMT 2025 , Edited by admin on Mon Mar 31 18:26:58 GMT 2025
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280-515-7
Created by
admin on Mon Mar 31 18:26:58 GMT 2025 , Edited by admin on Mon Mar 31 18:26:58 GMT 2025
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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