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Details

Stereochemistry ACHIRAL
Molecular Formula C13H18Cl2N2.ClH
Molecular Weight 309.662
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(3-CHLOROPHENYL)-4-(3-CHLOROPROPYL)-PIPERAZINE HYDROCHLORIDE

SMILES

Cl.ClCCCN1CCN(CC1)C2=CC=CC(Cl)=C2

InChI

InChIKey=JVLRNANYLVRULL-UHFFFAOYSA-N
InChI=1S/C13H18Cl2N2.ClH/c14-5-2-6-16-7-9-17(10-8-16)13-4-1-3-12(15)11-13;/h1,3-4,11H,2,5-10H2;1H

HIDE SMILES / InChI
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
Molecular Formula C13H18Cl2N2
Molecular Weight 273.201
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
149124
Substance Class Chemical
Created
by admin
on Mon Mar 31 22:36:43 GMT 2025
Edited
by admin
on Mon Mar 31 22:36:43 GMT 2025
Record UNII
2692F180CJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRAZODONE RELATED COMPOUND F
USP   USP-RS  
Preferred Name English
1-(3-CHLOROPHENYL)-4-(3-CHLOROPROPYL)-PIPERAZINE HYDROCHLORIDE
Systematic Name English
TRAZODONE RELATED COMPOUND F [USP IMPURITY]
Common Name English
PIPERAZINE, 1-(3-CHLOROPHENYL)-4-(3-CHLOROPROPYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
NEFAZODONE RELATED COMPOUND A
USP  
Common Name English
NEFAZODONE RELATED COMPOUND A [USP-RS]
Common Name English
TRAZODONE RELATED COMPOUND F [USP-RS]
Common Name English
NEFAZODONE RELATED COMPOUND A [USP IMPURITY]
Common Name English
Code System Code Type Description
CAS
52605-52-4
Created by admin on Mon Mar 31 22:36:43 GMT 2025 , Edited by admin on Mon Mar 31 22:36:43 GMT 2025
PRIMARY
ECHA (EC/EINECS)
258-038-0
Created by admin on Mon Mar 31 22:36:43 GMT 2025 , Edited by admin on Mon Mar 31 22:36:43 GMT 2025
PRIMARY
CAS
57059-62-8
Created by admin on Mon Mar 31 22:36:43 GMT 2025 , Edited by admin on Mon Mar 31 22:36:43 GMT 2025
NON-SPECIFIC STOICHIOMETRY
EPA CompTox
DTXSID9057761
Created by admin on Mon Mar 31 22:36:43 GMT 2025 , Edited by admin on Mon Mar 31 22:36:43 GMT 2025
PRIMARY
RS_ITEM_NUM
1457913
Created by admin on Mon Mar 31 22:36:43 GMT 2025 , Edited by admin on Mon Mar 31 22:36:43 GMT 2025
PRIMARY
PUBCHEM
3016761
Created by admin on Mon Mar 31 22:36:43 GMT 2025 , Edited by admin on Mon Mar 31 22:36:43 GMT 2025
PRIMARY
RS_ITEM_NUM
1673566
Created by admin on Mon Mar 31 22:36:43 GMT 2025 , Edited by admin on Mon Mar 31 22:36:43 GMT 2025
ALTERNATIVE
FDA UNII
2692F180CJ
Created by admin on Mon Mar 31 22:36:43 GMT 2025 , Edited by admin on Mon Mar 31 22:36:43 GMT 2025
PRIMARY
Related Record Type Details
Structure of 1-(3-CHLOROPHENYL)-4-(3-CHLOROPROPYL)-PIPERAZINE
PARENT -> SALT/SOLVATE
NIH
NCATS
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