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Details

Stereochemistry ACHIRAL
Molecular Formula C13H23N4O2.BF4
Molecular Weight 354.152
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(4,6-Diethoxy-s-triazin-2-yl)-1-methylpiperidinium tetrafluoroborate

SMILES

F[B-](F)(F)F.CCOC1=NC(=NC(OCC)=N1)[N+]2(C)CCCCC2

InChI

InChIKey=ZTVOUYKTAOUVJH-UHFFFAOYSA-N
InChI=1S/C13H23N4O2.BF4/c1-4-18-12-14-11(15-13(16-12)19-5-2)17(3)9-7-6-8-10-17;2-1(3,4)5/h4-10H2,1-3H3;/q+1;-1

HIDE SMILES / InChI

Molecular Formula BF4
Molecular Weight 86.805
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C13H23N4O2
Molecular Weight 267.3473
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 12:13:44 GMT 2023
Edited
by admin
on Sat Dec 16 12:13:44 GMT 2023
Record UNII
NFS2GJX2TN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(4,6-Diethoxy-s-triazin-2-yl)-1-methylpiperidinium tetrafluoroborate
Systematic Name English
2,4-diethoxy-6-(1-methylpiperidin-1-ium-1-yl)-1,3,5-triazine,tetrafluoroborate
Systematic Name English
Piperidinium, 1-(4,6-diethoxy-1,3,5-triazin-2-yl)-1-methyl-, tetrafluoroborate(1-) (1:1)
Systematic Name English
Piperidinium, 1-(4,6-diethoxy-1,3,5-triazin-2-yl)-1-methyl-, tetrafluoroborate(1-)
Systematic Name English
1-(4,6-Diethoxy-1,3,5-triazin-2-yl)-1-methylpiperidinium tetrafluoroborate
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
255-479-0
Created by admin on Sat Dec 16 12:13:44 GMT 2023 , Edited by admin on Sat Dec 16 12:13:44 GMT 2023
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FDA UNII
NFS2GJX2TN
Created by admin on Sat Dec 16 12:13:44 GMT 2023 , Edited by admin on Sat Dec 16 12:13:44 GMT 2023
PRIMARY
CAS
41654-51-7
Created by admin on Sat Dec 16 12:13:44 GMT 2023 , Edited by admin on Sat Dec 16 12:13:44 GMT 2023
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PUBCHEM
20841627
Created by admin on Sat Dec 16 12:13:44 GMT 2023 , Edited by admin on Sat Dec 16 12:13:44 GMT 2023
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EPA CompTox
DTXSID20194475
Created by admin on Sat Dec 16 12:13:44 GMT 2023 , Edited by admin on Sat Dec 16 12:13:44 GMT 2023
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Related Record Type Details
PARENT -> SALT/SOLVATE