(4-Phthalimidobutyl)triphenylphosphonium bromide

Details

Stereochemistry	ACHIRAL
Molecular Formula	C30H27NO2P.Br
Molecular Weight	544.419
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (4-Phthalimidobutyl)triphenylphosphonium bromide

Structure Search

SMILES

[Br-].O=C1N(CCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C5=CC=CC=C15

InChI

InChIKey=YKNPTFHDEQEFAS-UHFFFAOYSA-M

InChI=1S/C30H27NO2P.BrH/c32-29-27-20-10-11-21-28(27)30(33)31(29)22-12-13-23-34(24-14-4-1-5-15-24,25-16-6-2-7-17-25)26-18-8-3-9-19-26;/h1-11,14-21H,12-13,22-23H2;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C30H27NO2P
Molecular Weight	464.5146
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	Br
Molecular Weight	79.904
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 `Tue Apr 01 19:36:22 GMT 2025` Edited by `admin` on `Tue Apr 01 19:36:22 GMT 2025`
Record UNII	2GKH44WNY8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-251818

Preferred Name

English

(4-Phthalimidobutyl)triphenylphosphonium bromide

Systematic Name

English

2-(4-(TRIPHENYLPHOSPHORANYL)BUTYL)-1H-ISOINDOLE-1,3(2H)-DIONE

Systematic Name

English

Phosphonium, [4-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)butyl]triphenyl-, bromide (1:1)

Systematic Name

English

[4-(1,3-Dioxo-1,3-dihydroisoindol-2-yl)butyl]triphenylphosphonium bromide

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID70983876