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Details

Stereochemistry ACHIRAL
Molecular Formula C10H22Cl2N2.2Cl
Molecular Weight 312.107
Optical Activity NONE
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,4-Bis(2-chloroethyl)-1,4-dimethylpiperazinium dichloride, trans-

SMILES

[Cl-].[Cl-].C[N@@+]1(CCCl)CC[N@@+](C)(CCCl)CC1

InChI

InChIKey=ANZGQGAJGAEASQ-MXPSUWBQSA-L
InChI=1S/C10H22Cl2N2.2ClH/c1-13(5-3-11)7-9-14(2,6-4-12)10-8-13;;/h3-10H2,1-2H3;2*1H/q+2;;/p-2/t13-,14-;;

HIDE SMILES / InChI

Molecular Formula C10H22Cl2N2
Molecular Weight 241.201
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity NONE

Molecular Formula Cl
Molecular Weight 35.453
Charge -1
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 21:13:31 GMT 2025
Edited
by admin
on Wed Apr 02 21:13:31 GMT 2025
Record UNII
G4RTJ8K8K7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Piperazinium, 1,4-bis(2-chloroethyl)-1,4-dimethyl-, dichloride, trans-
Preferred Name English
1,4-Bis(2-chloroethyl)-1,4-dimethylpiperazinium dichloride, trans-
Systematic Name English
Code System Code Type Description
FDA UNII
G4RTJ8K8K7
Created by admin on Wed Apr 02 21:13:31 GMT 2025 , Edited by admin on Wed Apr 02 21:13:31 GMT 2025
PRIMARY
CAS
111036-17-0
Created by admin on Wed Apr 02 21:13:31 GMT 2025 , Edited by admin on Wed Apr 02 21:13:31 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE