Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | 2C9H13N.H2O4S |
| Molecular Weight | 368.491 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.CC(C)C1=CC=C(N)C=C1.CC(C)C2=CC=C(N)C=C2
InChI
InChIKey=FDACJDKLINIVBM-UHFFFAOYSA-N
InChI=1S/2C9H13N.H2O4S/c2*1-7(2)8-3-5-9(10)6-4-8;1-5(2,3)4/h2*3-7H,10H2,1-2H3;(H2,1,2,3,4)
| Molecular Formula | H2O4S |
| Molecular Weight | 98.078 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C9H13N |
| Molecular Weight | 135.2062 |
| 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 21:13:51 GMT 2025
by
admin
on
Mon Mar 31 21:13:51 GMT 2025
|
| Record UNII |
79819H507R
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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m3880
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PRIMARY | Merck Index | ||
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71586826
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DTXSID30207666
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5892-71-7
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admin on Mon Mar 31 21:13:51 GMT 2025 , Edited by admin on Mon Mar 31 21:13:51 GMT 2025
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79819H507R
Created by
admin on Mon Mar 31 21:13:51 GMT 2025 , Edited by admin on Mon Mar 31 21:13:51 GMT 2025
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