Trimethylphenylammonium Tribromide

CAT: 1442-11913015 10Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1442-11913015 10Size:10 mg

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CAS Number

4207-56-1

Molecular Formula

C9H14Br3N

Molecular Weight

375.93

HSN Code

29239000

Chemical Information

Benzenaminium, N,N,N-trimethyl-, (tribromide) (1:1)

CAS Number	4207-56-1
PubChem CID	77880
Molecular Formula	C9H14Br3N
Molecular Weight	375.93
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	95

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

Chemical Structure

2D Structure

CAS: 4207-56-1

CID: 77880

Formula: C9H14Br3N

MW: 375.93

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	375.93
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	374.86559
Monoisotopic Mass	372.86764
Topological Polar Surface Area	0 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	95.8
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
116870 100	Phosphorous Tribromide
116870 500	Phosphorous Tribromide

Catalog	Name
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