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Details

Stereochemistry ACHIRAL
Molecular Formula C13H27N2.I
Molecular Weight 338.2714
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-Ethyl-1-(piperidinomethyl)piperidinium iodide

SMILES

[I-].CC[N+]2(CN1CCCCC1)CCCCC2

InChI

InChIKey=LCBPTCKYUGUDNM-UHFFFAOYSA-M
InChI=1S/C13H27N2.HI/c1-2-15(11-7-4-8-12-15)13-14-9-5-3-6-10-14;/h2-13H2,1H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula HI
Molecular Weight 127.9124
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C13H27N2
Molecular Weight 211.3669
Charge 1
Count
Stereochemistry RACEMIC
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 12:42:08 GMT 2023
Edited
by admin
on Sat Dec 16 12:42:08 GMT 2023
Record UNII
5DTU7PS6RQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-Ethyl-1-(piperidinomethyl)piperidinium iodide
Systematic Name English
Piperidinium, 1-ethyl-1-(1-piperidinylmethyl)-, iodide
Systematic Name English
Piperidinium, 1-ethyl-1-(1-piperidinylmethyl)-, iodide (1:1)
Systematic Name English
Piperidinium, 1-ethyl-1-piperidinomethyl-, iodide
Systematic Name English
NSC-203168
Code English
Code System Code Type Description
FDA UNII
5DTU7PS6RQ
Created by admin on Sat Dec 16 12:42:08 GMT 2023 , Edited by admin on Sat Dec 16 12:42:08 GMT 2023
PRIMARY
NSC
203168
Created by admin on Sat Dec 16 12:42:08 GMT 2023 , Edited by admin on Sat Dec 16 12:42:08 GMT 2023
PRIMARY
CAS
73771-90-1
Created by admin on Sat Dec 16 12:42:08 GMT 2023 , Edited by admin on Sat Dec 16 12:42:08 GMT 2023
PRIMARY
EPA CompTox
DTXSID50994708
Created by admin on Sat Dec 16 12:42:08 GMT 2023 , Edited by admin on Sat Dec 16 12:42:08 GMT 2023
PRIMARY
PUBCHEM
3056448
Created by admin on Sat Dec 16 12:42:08 GMT 2023 , Edited by admin on Sat Dec 16 12:42:08 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE