PHENYLTRIMETHYLAMMONIUM TRIBROMIDE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H14N.Br3
Molecular Weight	375.926
Optical Activity	NONE
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PHENYLTRIMETHYLAMMONIUM TRIBROMIDE

Structure Search

SMILES

Br[Br-]Br.C[N+](C)(C)C1=CC=CC=C1

InChI

InChIKey=PRXNKYBFWAWBNZ-UHFFFAOYSA-N

InChI=1S/C9H14N.Br3/c1-10(2,3)9-7-5-4-6-8-9;1-3-2/h4-8H,1-3H3;/q+1;-1

HIDE SMILES / InChI

Molecular Formula	C9H14N
Molecular Weight	136.2142
Charge	1
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	Br3
Molecular Weight	239.712
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 19:56:38 GMT 2025` Edited by `admin` on `Tue Apr 01 19:56:38 GMT 2025`
Record UNII	9V4E7J2MSS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PHENYLTRIMETHYLAMMONIUM TRIBROMIDE

Systematic Name

English

NSC-138640

Preferred Name

English

NSC-87897

Code

English

TRIMETHYLPHENYLAMMONIUM PERBROMIDE

Systematic Name

English

NSC-173340

Code

English

BENZENAMINIUM, N,N,N-TRIMETHYL-, (TRIBROMIDE) (1:1)

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID30962263

Created by admin on Tue Apr 01 19:56:38 GMT 2025 , Edited by admin on Tue Apr 01 19:56:38 GMT 2025

PRIMARY

PUBCHEM

77880

Created by admin on Tue Apr 01 19:56:38 GMT 2025 , Edited by admin on Tue Apr 01 19:56:38 GMT 2025

PRIMARY

NSC

87897

Created by admin on Tue Apr 01 19:56:38 GMT 2025 , Edited by admin on Tue Apr 01 19:56:38 GMT 2025

PRIMARY

NSC

173340

Created by admin on Tue Apr 01 19:56:38 GMT 2025 , Edited by admin on Tue Apr 01 19:56:38 GMT 2025

PRIMARY

FDA UNII

9V4E7J2MSS

Created by admin on Tue Apr 01 19:56:38 GMT 2025 , Edited by admin on Tue Apr 01 19:56:38 GMT 2025

PRIMARY

NSC

138640

Created by admin on Tue Apr 01 19:56:38 GMT 2025 , Edited by admin on Tue Apr 01 19:56:38 GMT 2025

PRIMARY

ECHA (EC/EINECS)

224-127-8

Created by admin on Tue Apr 01 19:56:38 GMT 2025 , Edited by admin on Tue Apr 01 19:56:38 GMT 2025

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CAS

4207-56-1

Created by admin on Tue Apr 01 19:56:38 GMT 2025 , Edited by admin on Tue Apr 01 19:56:38 GMT 2025

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Related Record Type Details


					5L1SB9421A

TRIBROMIDE ANION

PARENT -> SALT/SOLVATE