U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C32H68P.Br
Molecular Weight 563.76
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Tetraoctylphosphonium bromide

SMILES

[Br-].CCCCCCCC[P+](CCCCCCCC)(CCCCCCCC)CCCCCCCC

InChI

InChIKey=QVBRLOSUBRKEJW-UHFFFAOYSA-M
InChI=1S/C32H68P.BrH/c1-5-9-13-17-21-25-29-33(30-26-22-18-14-10-6-2,31-27-23-19-15-11-7-3)32-28-24-20-16-12-8-4;/h5-32H2,1-4H3;1H/q+1;/p-1

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 C32H68P
Molecular Weight 483.8561
Charge 1
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 Mon Mar 31 22:04:10 GMT 2025
Edited
by admin
on Mon Mar 31 22:04:10 GMT 2025
Record UNII
4DW4BJ8UKX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Tetraoctylphosphonium bromide
Systematic Name English
Phosphonium, tetraoctyl-, bromide
Preferred Name English
Phosphonium, tetraoctyl-, bromide (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
4DW4BJ8UKX
Created by admin on Mon Mar 31 22:04:10 GMT 2025 , Edited by admin on Mon Mar 31 22:04:10 GMT 2025
PRIMARY
ECHA (EC/EINECS)
245-935-7
Created by admin on Mon Mar 31 22:04:10 GMT 2025 , Edited by admin on Mon Mar 31 22:04:10 GMT 2025
PRIMARY
EPA CompTox
DTXSID5047900
Created by admin on Mon Mar 31 22:04:10 GMT 2025 , Edited by admin on Mon Mar 31 22:04:10 GMT 2025
PRIMARY
CAS
23906-97-0
Created by admin on Mon Mar 31 22:04:10 GMT 2025 , Edited by admin on Mon Mar 31 22:04:10 GMT 2025
PRIMARY
PUBCHEM
3015167
Created by admin on Mon Mar 31 22:04:10 GMT 2025 , Edited by admin on Mon Mar 31 22:04:10 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE