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Details

Stereochemistry ACHIRAL
Molecular Formula C23H24O2P.Br
Molecular Weight 443.313
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4-Carboxybutyl)triphenylphosphonium bromide

SMILES

[Br-].OC(=O)CCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChIKey=MLOSJPZSZWUDSK-UHFFFAOYSA-N
InChI=1S/C23H23O2P.BrH/c24-23(25)18-10-11-19-26(20-12-4-1-5-13-20,21-14-6-2-7-15-21)22-16-8-3-9-17-22;/h1-9,12-17H,10-11,18-19H2;1H

HIDE SMILES / InChI

Molecular Formula C23H23O2P
Molecular Weight 362.4013
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:21:58 GMT 2025
Edited
by admin
on Tue Apr 01 19:21:58 GMT 2025
Record UNII
U574RP8CHR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(4-Carboxybutyl)triphenylphosphonium bromide
Systematic Name English
NSC-147756
Preferred Name English
Carboxybutyltriphenylphosphonium bromide
Systematic Name English
5-(Triphenylphosphonio)pentanoic acid bromide
Systematic Name English
Phosphonium, (4-carboxybutyl)triphenyl-, bromide
Systematic Name English
Triphenyl(4-carboxybutyl)phosphonium bromide
Systematic Name English
Phosphonium, (4-carboxybutyl)triphenyl-, bromide (1:1)
Systematic Name English
Code System Code Type Description
CAS
17814-85-6
Created by admin on Tue Apr 01 19:21:58 GMT 2025 , Edited by admin on Tue Apr 01 19:21:58 GMT 2025
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FDA UNII
U574RP8CHR
Created by admin on Tue Apr 01 19:21:58 GMT 2025 , Edited by admin on Tue Apr 01 19:21:58 GMT 2025
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PUBCHEM
161236
Created by admin on Tue Apr 01 19:21:58 GMT 2025 , Edited by admin on Tue Apr 01 19:21:58 GMT 2025
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ECHA (EC/EINECS)
241-782-5
Created by admin on Tue Apr 01 19:21:58 GMT 2025 , Edited by admin on Tue Apr 01 19:21:58 GMT 2025
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EPA CompTox
DTXSID6057669
Created by admin on Tue Apr 01 19:21:58 GMT 2025 , Edited by admin on Tue Apr 01 19:21:58 GMT 2025
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NSC
147756
Created by admin on Tue Apr 01 19:21:58 GMT 2025 , Edited by admin on Tue Apr 01 19:21:58 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE