Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C13H17N3.ClH.H2O |
| Molecular Weight | 269.77 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.Cl.C1CN=C(NC2=C3CCCCC3=CC=C2)N1
InChI
InChIKey=FDPYEAXJRLQOGE-UHFFFAOYSA-N
InChI=1S/C13H17N3.ClH.H2O/c1-2-6-11-10(4-1)5-3-7-12(11)16-13-14-8-9-15-13;;/h3,5,7H,1-2,4,6,8-9H2,(H2,14,15,16);1H;1H2
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C13H17N3 |
| Molecular Weight | 215.2942 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| 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
Fri Dec 15 18:46:01 UTC 2023
by
admin
on
Fri Dec 15 18:46:01 UTC 2023
|
| Record UNII |
9DF5N42U1U
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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74195-73-6
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19379147
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SUB20996
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DTXSID30225188
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admin on Fri Dec 15 18:46:01 UTC 2023 , Edited by admin on Fri Dec 15 18:46:01 UTC 2023
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9DF5N42U1U
Created by
admin on Fri Dec 15 18:46:01 UTC 2023 , Edited by admin on Fri Dec 15 18:46:01 UTC 2023
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100000087292
Created by
admin on Fri Dec 15 18:46:01 UTC 2023 , Edited by admin on Fri Dec 15 18:46:01 UTC 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE | |||
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ANHYDROUS->SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |