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Details

Stereochemistry ACHIRAL
Molecular Formula C26H22OP.Br
Molecular Weight 461.33
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Phenacyltriphenylphosphonium bromide

SMILES

[Br-].O=C(C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChIKey=AEHDSYHVTDJGDN-UHFFFAOYSA-M
InChI=1S/C26H22OP.BrH/c27-26(22-13-5-1-6-14-22)21-28(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25;/h1-20H,21H2;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C26H22OP
Molecular Weight 381.426
Charge 1
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 19:45:05 GMT 2025
Edited
by admin
on Tue Apr 01 19:45:05 GMT 2025
Record UNII
7Q4EJF9TR6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-6743
Preferred Name English
Phenacyltriphenylphosphonium bromide
Systematic Name English
Phosphonium, (2-oxo-2-phenylethyl)triphenyl-, bromide (1:1)
Systematic Name English
Phosphonium, (2-oxo-2-phenylethyl)triphenyl-, bromide
Systematic Name English
Phosphonium, phenacyltriphenyl-, bromide
Systematic Name English
Code System Code Type Description
NSC
6743
Created by admin on Tue Apr 01 19:45:05 GMT 2025 , Edited by admin on Tue Apr 01 19:45:05 GMT 2025
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EPA CompTox
DTXSID40975889
Created by admin on Tue Apr 01 19:45:05 GMT 2025 , Edited by admin on Tue Apr 01 19:45:05 GMT 2025
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FDA UNII
7Q4EJF9TR6
Created by admin on Tue Apr 01 19:45:05 GMT 2025 , Edited by admin on Tue Apr 01 19:45:05 GMT 2025
PRIMARY
PUBCHEM
197064
Created by admin on Tue Apr 01 19:45:05 GMT 2025 , Edited by admin on Tue Apr 01 19:45:05 GMT 2025
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ECHA (EC/EINECS)
227-945-3
Created by admin on Tue Apr 01 19:45:05 GMT 2025 , Edited by admin on Tue Apr 01 19:45:05 GMT 2025
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CAS
6048-29-9
Created by admin on Tue Apr 01 19:45:05 GMT 2025 , Edited by admin on Tue Apr 01 19:45:05 GMT 2025
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