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Details

Stereochemistry ACHIRAL
Molecular Formula C13H16ClN3.ClH
Molecular Weight 286.2
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(3-CHLOROPHENYL)PIPERAZINE-1-PROPIONONITRILE MONOHYDROCHLORIDE

SMILES

Cl.ClC1=CC(=CC=C1)N2CCN(CCC#N)CC2

InChI

InChIKey=HZYBADZYPWHPSH-UHFFFAOYSA-N
InChI=1S/C13H16ClN3.ClH/c14-12-3-1-4-13(11-12)17-9-7-16(8-10-17)6-2-5-15;/h1,3-4,11H,2,6-10H2;1H

HIDE SMILES / InChI

Molecular Formula C13H16ClN3
Molecular Weight 249.739
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 Sat Dec 16 12:29:06 GMT 2023
Edited
by admin
on Sat Dec 16 12:29:06 GMT 2023
Record UNII
A7Y5FRU0FZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(3-CHLOROPHENYL)PIPERAZINE-1-PROPIONONITRILE MONOHYDROCHLORIDE
Systematic Name English
1-PIPERAZINEPROPANENITRILE, 4-(3-CHLOROPHENYL)-, MONOHYDROCHLORIDE (9CI
Systematic Name English
1-PIPERAZINEPROPANENITRILE, 4-(3-CHLOROPHENYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID60194813
Created by admin on Sat Dec 16 12:29:06 GMT 2023 , Edited by admin on Sat Dec 16 12:29:06 GMT 2023
PRIMARY
ECHA (EC/EINECS)
255-620-6
Created by admin on Sat Dec 16 12:29:06 GMT 2023 , Edited by admin on Sat Dec 16 12:29:06 GMT 2023
PRIMARY
FDA UNII
A7Y5FRU0FZ
Created by admin on Sat Dec 16 12:29:06 GMT 2023 , Edited by admin on Sat Dec 16 12:29:06 GMT 2023
PRIMARY
CAS
42002-65-3
Created by admin on Sat Dec 16 12:29:06 GMT 2023 , Edited by admin on Sat Dec 16 12:29:06 GMT 2023
PRIMARY
PUBCHEM
21149445
Created by admin on Sat Dec 16 12:29:06 GMT 2023 , Edited by admin on Sat Dec 16 12:29:06 GMT 2023
PRIMARY