Details
Stereochemistry | ACHIRAL |
Molecular Formula | C13H13O3S.Na |
Molecular Weight | 272.295 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Na+].CC(C)C1=C2C=CC=CC2=C(C=C1)S([O-])(=O)=O
InChI
InChIKey=ANSCQMQJAJIABZ-UHFFFAOYSA-M
InChI=1S/C13H14O3S.Na/c1-9(2)10-7-8-13(17(14,15)16)12-6-4-3-5-11(10)12;/h3-9H,1-2H3,(H,14,15,16);/q;+1/p-1
Molecular Formula | Na |
Molecular Weight | 22.9898 |
Charge | 1 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C13H13O3S |
Molecular Weight | 249.306 |
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
Sat Dec 16 12:27:50 GMT 2023
by
admin
on
Sat Dec 16 12:27:50 GMT 2023
|
Record UNII |
HA2CBE44SU
|
Record Status |
Validated (UNII)
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Record Version |
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-
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DTXSID50203685
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HA2CBE44SU
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55184-48-0
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23663703
Created by
admin on Sat Dec 16 12:27:50 GMT 2023 , Edited by admin on Sat Dec 16 12:27:50 GMT 2023
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