Details
Stereochemistry | ACHIRAL |
Molecular Formula | C7H9N2O.Br |
Molecular Weight | 217.063 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
Stereo Comments | Assumed E-isomer as in chloride salt in USP/NF |
SHOW SMILES / InChI
SMILES
[Br-].C[N+]1=C(\C=N\O)C=CC=C1
InChI
InChIKey=UHVXAXRWEJONPZ-UHFFFAOYSA-N
InChI=1S/C7H8N2O.BrH/c1-9-5-3-2-4-7(9)6-8-10;/h2-6H,1H3;1H
Molecular Formula | C7H8N2O |
Molecular Weight | 136.1512 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Molecular Formula | BrH |
Molecular Weight | 80.912 |
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
Sat Dec 16 10:42:38 UTC 2023
by
admin
on
Sat Dec 16 10:42:38 UTC 2023
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Record UNII |
ON33043VUD
|
Record Status |
Validated (UNII)
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Record Version |
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-
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1532-28-1
Created by
admin on Sat Dec 16 10:42:38 UTC 2023 , Edited by admin on Sat Dec 16 10:42:38 UTC 2023
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NON-SPECIFIC STEREOCHEMISTRY | |||
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14018-51-0
Created by
admin on Sat Dec 16 10:42:38 UTC 2023 , Edited by admin on Sat Dec 16 10:42:38 UTC 2023
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PRIMARY | |||
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ON33043VUD
Created by
admin on Sat Dec 16 10:42:38 UTC 2023 , Edited by admin on Sat Dec 16 10:42:38 UTC 2023
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PRIMARY | |||
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135565168
Created by
admin on Sat Dec 16 10:42:38 UTC 2023 , Edited by admin on Sat Dec 16 10:42:38 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |