Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C20H29ClN2O2.BrH |
| Molecular Weight | 445.821 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Br.CCC1=C(CCCCCCOC2=CC=C(OC)C=C2Cl)C(CC)=NN1
InChI
InChIKey=BNDAQGDHKLUFSM-UHFFFAOYSA-N
InChI=1S/C20H29ClN2O2.BrH/c1-4-18-16(19(5-2)23-22-18)10-8-6-7-9-13-25-20-12-11-15(24-3)14-17(20)21;/h11-12,14H,4-10,13H2,1-3H3,(H,22,23);1H
| Molecular Formula | C20H29ClN2O2 |
| Molecular Weight | 364.909 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| 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
Wed Apr 02 14:23:47 GMT 2025
by
admin
on
Wed Apr 02 14:23:47 GMT 2025
|
| Record UNII |
UK42M5NZ63
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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UK42M5NZ63
Created by
admin on Wed Apr 02 14:23:47 GMT 2025 , Edited by admin on Wed Apr 02 14:23:47 GMT 2025
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69982-47-4
Created by
admin on Wed Apr 02 14:23:47 GMT 2025 , Edited by admin on Wed Apr 02 14:23:47 GMT 2025
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166177227
Created by
admin on Wed Apr 02 14:23:47 GMT 2025 , Edited by admin on Wed Apr 02 14:23:47 GMT 2025
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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![Structure of 4-[6-(2-Chloro-4-methoxyphenoxy)hexyl]-3,5-diethyl-1H-pyrazole](/img/69360230-bdfb-43f8-a756-58ac4d3b06ae.svg "Structure of 4-[6-(2-Chloro-4-methoxyphenoxy)hexyl]-3,5-diethyl-1H-pyrazole")