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Details

Stereochemistry ACHIRAL
Molecular Formula C34H74N2O2.2Br
Molecular Weight 702.772
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,6-DIOXAOCTAMETHYLENE-1,8-BIS(DODECYLDIMETHYLAMMONIUM BROMIDE)

SMILES

[Br-].[Br-].CCCCCCCCCCCC[N+](C)(C)CCOCCOCC[N+](C)(C)CCCCCCCCCCCC

InChI

InChIKey=RQPWQGOPYTWRNF-UHFFFAOYSA-L
InChI=1S/C34H74N2O2.2BrH/c1-7-9-11-13-15-17-19-21-23-25-27-35(3,4)29-31-37-33-34-38-32-30-36(5,6)28-26-24-22-20-18-16-14-12-10-8-2;;/h7-34H2,1-6H3;2*1H/q+2;;/p-2

HIDE SMILES / InChI

Molecular Formula BrH
Molecular Weight 80.912
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C34H74N2O2
Molecular Weight 542.9636
Charge 2
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 14:44:00 GMT 2023
Edited
by admin
on Sat Dec 16 14:44:00 GMT 2023
Record UNII
OE4O4Z0Q2P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,6-DIOXAOCTAMETHYLENE-1,8-BIS(DODECYLDIMETHYLAMMONIUM BROMIDE)
Systematic Name English
1-DODECANAMINIUM, N,N'-(1,2-ETHANEDIYLBIS(OXY-2,1-ETHANEDIYL))BIS(N,N-DIMETHYL-, BROMIDE (1:2)
Systematic Name English
N,N'-(1,2-ETHANEDIYLBIS(OXY-2,1-ETHANEDIYL))BIS(N,N-DIMETHYL-1-DODECANAMINIUM) BROMIDE (1:2)
Systematic Name English
Code System Code Type Description
CAS
209606-40-6
Created by admin on Sat Dec 16 14:44:00 GMT 2023 , Edited by admin on Sat Dec 16 14:44:00 GMT 2023
PRIMARY
FDA UNII
OE4O4Z0Q2P
Created by admin on Sat Dec 16 14:44:00 GMT 2023 , Edited by admin on Sat Dec 16 14:44:00 GMT 2023
PRIMARY
PUBCHEM
133082671
Created by admin on Sat Dec 16 14:44:00 GMT 2023 , Edited by admin on Sat Dec 16 14:44:00 GMT 2023
PRIMARY
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