Details
Stereochemistry | ACHIRAL |
Molecular Formula | C13H14N2.ClH.H2O |
Molecular Weight | 252.74 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.Cl.NC1=C2CCCCC2=NC3=C1C=CC=C3
InChI
InChIKey=PXGRMZYJAOQPNZ-UHFFFAOYSA-N
InChI=1S/C13H14N2.ClH.H2O/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13;;/h1,3,5,7H,2,4,6,8H2,(H2,14,15);1H;1H2
Molecular Formula | C13H14N2 |
Molecular Weight | 198.2637 |
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 |
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 |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 05:54:51 UTC 2023
by
admin
on
Sat Dec 16 05:54:51 UTC 2023
|
Record UNII |
MQ603P8SBL
|
Record Status |
Validated (UNII)
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Record Version |
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-
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MQ603P8SBL
Created by
admin on Sat Dec 16 05:54:51 UTC 2023 , Edited by admin on Sat Dec 16 05:54:51 UTC 2023
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DTXSID80221711
Created by
admin on Sat Dec 16 05:54:51 UTC 2023 , Edited by admin on Sat Dec 16 05:54:51 UTC 2023
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6420002
Created by
admin on Sat Dec 16 05:54:52 UTC 2023 , Edited by admin on Sat Dec 16 05:54:52 UTC 2023
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7149-50-0
Created by
admin on Sat Dec 16 05:54:51 UTC 2023 , Edited by admin on Sat Dec 16 05:54:51 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 |