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Details

Stereochemistry ACHIRAL
Molecular Formula C5H9NO.ClH.H2O
Molecular Weight 153.607
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Piperidone hydrochloride hydrate

SMILES

O.Cl.O=C1CCNCC1

InChI

InChIKey=SXWRTZOXMUOJER-UHFFFAOYSA-N
InChI=1S/C5H9NO.ClH.H2O/c7-5-1-3-6-4-2-5;;/h6H,1-4H2;1H;1H2

HIDE SMILES / InChI

Molecular Formula H2O
Molecular Weight 18.0153
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C5H9NO
Molecular Weight 99.1311
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 20:18:11 GMT 2023
Edited
by admin
on Sat Dec 16 20:18:11 GMT 2023
Record UNII
8KV84ZVM5K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Piperidone hydrochloride hydrate
Systematic Name English
Piperidin-4-one hydrate hydrochloride
Systematic Name English
4-Piperidinone, hydrochloride, monohydrate
Systematic Name English
4-Piperidinone, hydrochloride, hydrate (1:1:1)
Systematic Name English
4-Piperidone monohydrate hydrochloride
Systematic Name English
Code System Code Type Description
FDA UNII
8KV84ZVM5K
Created by admin on Sat Dec 16 20:18:11 GMT 2023 , Edited by admin on Sat Dec 16 20:18:11 GMT 2023
PRIMARY
CAS
320589-77-3
Created by admin on Sat Dec 16 20:18:11 GMT 2023 , Edited by admin on Sat Dec 16 20:18:11 GMT 2023
PRIMARY
PUBCHEM
2723901
Created by admin on Sat Dec 16 20:18:11 GMT 2023 , Edited by admin on Sat Dec 16 20:18:11 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE