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Details

Stereochemistry ACHIRAL
Molecular Formula C6H14Cl2N2.2ClH
Molecular Weight 258.017
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N-Bis(2-chloroethyl)ethylenediamine dihydrochloride

SMILES

Cl.Cl.NCCN(CCCl)CCCl

InChI

InChIKey=MSMXPNLQOKKHKT-UHFFFAOYSA-N
InChI=1S/C6H14Cl2N2.2ClH/c7-1-4-10(5-2-8)6-3-9;;/h1-6,9H2;2*1H

HIDE SMILES / InChI

Molecular Formula C6H14Cl2N2
Molecular Weight 185.095
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 Tue Apr 01 19:37:21 GMT 2025
Edited
by admin
on Tue Apr 01 19:37:21 GMT 2025
Record UNII
76BKW7T53C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-364989
Preferred Name English
N,N-Bis(2-chloroethyl)ethylenediamine dihydrochloride
Common Name English
1,2-Ethanediamine, N1,N1-bis(2-chloroethyl)-, hydrochloride (1:2)
Systematic Name English
Code System Code Type Description
NSC
364989
Created by admin on Tue Apr 01 19:37:21 GMT 2025 , Edited by admin on Tue Apr 01 19:37:21 GMT 2025
PRIMARY
CAS
3399-66-4
Created by admin on Tue Apr 01 19:37:21 GMT 2025 , Edited by admin on Tue Apr 01 19:37:21 GMT 2025
PRIMARY
FDA UNII
76BKW7T53C
Created by admin on Tue Apr 01 19:37:21 GMT 2025 , Edited by admin on Tue Apr 01 19:37:21 GMT 2025
PRIMARY
EPA CompTox
DTXSID70187594
Created by admin on Tue Apr 01 19:37:21 GMT 2025 , Edited by admin on Tue Apr 01 19:37:21 GMT 2025
PRIMARY
PUBCHEM
19426052
Created by admin on Tue Apr 01 19:37:21 GMT 2025 , Edited by admin on Tue Apr 01 19:37:21 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE