Phenyltrimethylammonium tribromide supplier

Name
Phenyltrimethylammonium tribromide
EINECS 224-127-8
CAS No. 4207-56-1
Article Data4
CAS DataBase
Density 2.2071 (rough estimate)
Solubility insoluble
Melting Point 110-115 °C
Formula C₉H₁₄N^.Br₃
Boiling Point
Molecular Weight 375.929
Flash Point
Transport Information UN 3261
Appearance orange crystalline powder
Safety 26-36/37/39-45-24/25
Risk Codes 34-37
Molecular Structure
Hazard Symbols
Synonyms Trimethylphenylammonium tribromide;Benzenaminium, N,N,N-trimethyl-, (tribromide);Jacques reagent;Benzenaminium,N,N,N-trimethyl-,(tribromide);40379-10-0;Benzenaminium, N,N, N-trimethyl-, (tribromide);Ammonium, trimethylphenyl-, (tribromide);3426-74-2;
PSA 0.00000
LogP 0.57850

Synthetic route

: 16056-11-4
N,N,N-trimethylanilinium bromide

: 4207-56-1
phenyltrimethylammonium tribromide

Conditions

Conditions	Yield
With bromine

trimethylphenylammonium sulfate: trimethylphenylammonium sulfate

: 4207-56-1
phenyltrimethylammonium tribromide

Conditions

Conditions	Yield
With bromine

: 121-69-7
N,N-dimethyl-aniline

: 77-78-1
dimethyl sulfate

: 4207-56-1
phenyltrimethylammonium tribromide

Conditions

Conditions	Yield
Stage #1: N,N-dimethyl-aniline; dimethyl sulfate Stage #2: With hydrogen bromide; bromine

: 74-83-9
methyl bromide

: 121-69-7
N,N-dimethyl-aniline

: 4207-56-1
phenyltrimethylammonium tribromide

Conditions

Conditions	Yield
Stage #1: methyl bromide; N,N-dimethyl-aniline Stage #2: With bromine

: 1445973-84-1
(E)-1-(2-(2-nitrostyryl)-1-(phenylsulfonyl)-1H-indol-3-yl)ethanone

: 4207-56-1
phenyltrimethylammonium tribromide

: 1597408-27-9
(E)-2-bromo-1-[2-(2-nitrostyryl)-1-(phenylsulfonyl)-1H-indol-3-yl]-ethanone

Conditions

Conditions	Yield
In tetrahydrofuran at 10℃; for 1h;	78%

: 27628-06-4
1-(3,4-bis(benzyloxy)phenyl)ethan-1-one

: 4207-56-1
phenyltrimethylammonium tribromide

: 27628-05-3
2-bromo-3',4'-bis(benzyloxy)acetophenone

Conditions

Conditions	Yield
In tetrahydrofuran for 0.5h; Ambient temperature;	77.9%

: 139-28-6
3-acetylphenyl benzoate

: 4207-56-1
phenyltrimethylammonium tribromide

: 139-27-5
3-benzoyloxy-ω-bromoacetophenone

Conditions

Conditions	Yield
In tetrahydrofuran at 20℃; Inert atmosphere;	62%

: Ni*4(CH3)2SnSi(NC(CH3)3)2=Ni[(CH3)2Si(NC(CH3)3)2Sn]4

: 4207-56-1
phenyltrimethylammonium tribromide

A: 177702-82-8
Ni[(CH3)2Si(NC(CH3)3)2Sn]4Br2

B: 54677-67-7
(Me2Si(N-t-Bu)2)2Sn

C: 119395-68-5
1,3-di-t-butyl-2,2-dimethyl-4,4-dibromo-1,3,2,4-diazasilastannetidine

Conditions

Conditions	Yield
In hexane byproducts: NiBr2, SnBr2; N2-atmosphere; dropwise addn. of ammonium salt to Ni-complex soln. at -78°C; concn., crystn. (-30°C);	A 2.8% B 29% C 28%

...Expand

: 4207-56-1
phenyltrimethylammonium tribromide

: 67-64-1
acetone

: 16056-11-4
N,N,N-trimethylanilinium bromide

Conditions

Conditions	Yield
beim gelinden Erwaermen;

: 7732-18-5
water

: 4207-56-1
phenyltrimethylammonium tribromide

: 16056-11-4
N,N,N-trimethylanilinium bromide

Conditions

Conditions	Yield
beim Kochen;

: 7726-95-6
bromine

: 4207-56-1
phenyltrimethylammonium tribromide

iron: iron

trimethyl-<3.4-dibromo-phenyl>-ammonium bromide: trimethyl-<3.4-dibromo-phenyl>-ammonium bromide

Conditions

Conditions	Yield
at 100 - 120℃;

...Expand

: 7726-95-6
bromine

: 4207-56-1
phenyltrimethylammonium tribromide

iron: iron

trimethyl-<3-bromo-phenyl>-ammonium bromide: trimethyl-<3-bromo-phenyl>-ammonium bromide

Conditions

Conditions	Yield
at 70℃;

...Expand

: 1192260-72-2
2'-(4''-(benzyloxy)benzoyloxy)-4',6'-dibenzyloxyacetophenone

: 4207-56-1
phenyltrimethylammonium tribromide

: C36H28Br2O6

Conditions

Conditions	Yield
In tetrahydrofuran at 20℃;

: 1071575-79-5
Methyl 2-acetyl-1-naphthoate

: 4207-56-1
phenyltrimethylammonium tribromide

: 1258873-38-9
Methyl 2-(bromoacetyl)-1-naphthoate

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In Dimethyl ether at 20℃; for 3.5h;

: C42H36N2Ni2O4

: 4207-56-1
phenyltrimethylammonium tribromide

: C42H36Br2N2Ni2O4

Conditions

Conditions	Yield
In dichloromethane at -80℃; Inert atmosphere;

: C30H22N2Ni2O4

: 4207-56-1
phenyltrimethylammonium tribromide

: C30H22Br2N2Ni2O4

Conditions

Conditions	Yield
In dichloromethane-d2 at -80℃;

Phenyltrimethylammonium tribromide Chemical Properties

Product Name: Phenyltrimethylammonium tribromide
Empirical Formula: C₉H₁₄Br₃N
Molecular Weight: 375.92616
Canonical SMILES: C[N+](C)(C)C1=CC=CC=C1.Br[Br-]Br
InChI: 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
InChIKey: PRXNKYBFWAWBNZ-UHFFFAOYSA-N
EINECS: 224-127-8
Product Categories: Ammonium Polyhalides, etc. (Quaternary); Bromination; Halogenation; Quaternary Ammonium Compounds; Synthetic Organic Chemistry
Melting Point: 110-115 °C (dec.)(lit.)
storage temp.: Refrigerator
solubility: ethanol: 10 mg/mL hot, clear
Water Solubility: Insoluble
Sensitive: Hygroscopic
Appearance of Phenyltrimethylammonium tribromide (CAS NO.4207-56-1): orange crystalline powder

Phenyltrimethylammonium tribromide Safety Profile

Hazard Codes: Corrosive C
Risk Statements: 34-37
R34:Causes burns.
R37:Irritating to respiratory system
Safety Statements: 26-36/37/39-45-24/25
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
S24/25:Avoid contact with skin and eyes.
RIDADR: UN 3261 8/PG 2
WGK Germany: 3
HazardClass: 6.1(b)
PackingGroup: II

Phenyltrimethylammonium tribromide Specification

Phenyltrimethylammonium tribromide (CAS NO.4207-56-1), its Synonyms are Trimethylphenylammonium tribromide ; Jacques reagent ; Ammonium, trimethylphenyl-, (tribromide) ; Benzenaminium, N,N,N-trimethyl-, (tribromide) ; Benzenaminium, N,N,N-trimethyl-, (tribromide) (1:1) .

Product Name

Phenyltrimethylammonium tribromide

Synthetic route

Phenyltrimethylammonium tribromide Chemical Properties

Phenyltrimethylammonium tribromide Safety Profile

Phenyltrimethylammonium tribromide Specification

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