Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C8H12N2O.H2O4S |
| Molecular Weight | 250.272 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.COCC1=CC(N)=CC=C1N
InChI
InChIKey=YLQBIFHCMGEXTP-UHFFFAOYSA-N
InChI=1S/C8H12N2O.H2O4S/c1-11-5-6-4-7(9)2-3-8(6)10;1-5(2,3)4/h2-4H,5,9-10H2,1H3;(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 | C8H12N2O |
| Molecular Weight | 152.1937 |
| 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 20:44:52 GMT 2025
by
admin
on
Mon Mar 31 20:44:52 GMT 2025
|
| Record UNII |
53D5MY3Y8J
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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53D5MY3Y8J
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DTXSID10187452
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337906-37-3
Created by
admin on Mon Mar 31 20:44:52 GMT 2025 , Edited by admin on Mon Mar 31 20:44:52 GMT 2025
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17821393
Created by
admin on Mon Mar 31 20:44:52 GMT 2025 , Edited by admin on Mon Mar 31 20:44:52 GMT 2025
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| Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
