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Details

Stereochemistry ACHIRAL
Molecular Formula C11H16N2.BrH
Molecular Weight 257.17
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(3-Methylphenyl)piperazine hydrobromide

SMILES

Br.CC1=CC(=CC=C1)N2CCNCC2

InChI

InChIKey=GTAKYJCWUBTCST-UHFFFAOYSA-N
InChI=1S/C11H16N2.BrH/c1-10-3-2-4-11(9-10)13-7-5-12-6-8-13;/h2-4,9,12H,5-8H2,1H3;1H

HIDE SMILES / InChI

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

Molecular Formula C11H16N2
Molecular Weight 176.2581
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 Wed Apr 02 19:46:43 GMT 2025
Edited
by admin
on Wed Apr 02 19:46:43 GMT 2025
Record UNII
DRB9JRU8QQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(3-Methylphenyl)piperazine hydrobromide
Systematic Name English
Piperazine, 1-(3-methylphenyl)-, hydrobromide
Preferred Name English
Piperazine, 1-(3-methylphenyl)-, monohydrobromide
Systematic Name English
Piperazine, 1-(3-methylphenyl)-, hydrobromide (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
DRB9JRU8QQ
Created by admin on Wed Apr 02 19:46:43 GMT 2025 , Edited by admin on Wed Apr 02 19:46:43 GMT 2025
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CAS
649560-11-2
Created by admin on Wed Apr 02 19:46:43 GMT 2025 , Edited by admin on Wed Apr 02 19:46:43 GMT 2025
PRIMARY
PUBCHEM
91994569
Created by admin on Wed Apr 02 19:46:43 GMT 2025 , Edited by admin on Wed Apr 02 19:46:43 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE