Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C13H8O3S2 |
| Molecular Weight | 276.331 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC#CC1=CC=C(S1)C2=CC=C(S2)C(=O)C(O)=O
InChI
InChIKey=MGYRUJYDDGLKCS-UHFFFAOYSA-N
InChI=1S/C13H8O3S2/c1-2-3-8-4-5-9(17-8)10-6-7-11(18-10)12(14)13(15)16/h4-7H,1H3,(H,15,16)
| Molecular Formula | C13H8O3S2 |
| Molecular Weight | 276.331 |
| Charge | 0 |
| 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 20:06:54 GMT 2025
by
admin
on
Mon Mar 31 20:06:54 GMT 2025
|
| Record UNII |
5TG7A4P0YM
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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5TG7A4P0YM
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102054-36-4
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DTXSID90144563
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71587385
Created by
admin on Mon Mar 31 20:06:54 GMT 2025 , Edited by admin on Mon Mar 31 20:06:54 GMT 2025
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| Related Record | Type | Details | ||
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PARENT -> CONSTITUENT ALWAYS PRESENT |