Trihexyltetradecylphosphonium bromide

CAT: 1552-IN-0007-TG-0025Size: 25 gDry Ice: NoHazardous: No

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CAT#:1552-IN-0007-TG-0025Size:25 g

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CAS Number

654057-97-3

Product Name Alternative

IN 0007, 25 g

Purity

>95%

Molecular Formula

C32H68BrP

Molecular Weight

563.76

IUPAC Name

Trihexyltetradecylphosphonium bromide

Chemical Information

Trihexyltetradecylphosphonium bromide

CAS Number	654057-97-3
PubChem CID	16218822
IUPAC Name	trihexyl(tetradecyl)phosphanium bromide
Molecular Formula	C32H68BrP
Molecular Weight	563.8
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	28
Heavy Atom Count	34
Formal Charge	0
Complexity	319

SMILES

CCCCCCCCCCCCCC[P+](CCCCCC)(CCCCCC)CCCCCC.[Br-]

InChI

InChI=1S/C32H68P.BrH/c1-5-9-13-17-18-19-20-21-22-23-24-28-32-33(29-25-14-10-6-2,30-26-15-11-7-3)31-27-16-12-8-4;/h5-32H2,1-4H3;1H/q+1;/p-1

InChIKey

RJELOMHXBLDMDB-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 654057-97-3

CID: 16218822

Formula: C32H68BrP

MW: 563.8

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	563.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	28
Exact Mass	562.42420
Monoisotopic Mass	562.42420
Topological Polar Surface Area	0 Å²
Heavy Atom Count	34
Formal Charge	0
Complexity	319
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
IN-0042-HP-BULK	Trihexyltetradecylphosphonium dioctylsulfosuccinate
IN-0042-HP-0025	Trihexyltetradecylphosphonium dioctylsulfosuccinate
IN-0038-HP-5000	Trihexyltetradecylphosphonium tricyanomethanide
IN-0038-HP-0250	Trihexyltetradecylphosphonium tricyanomethanide
IN-0010-TG-0025	Trihexyltetradecylphosphonium dicyanamide
IN-0008-TG-0500	Trihexyltetradecylphosphonium decanoate
IN-0008-TG-0050	Trihexyltetradecylphosphonium decanoate
IN-0042-HP-0100	Trihexyltetradecylphosphonium dioctylsulfosuccinate
IN-0038-HP-0025	Trihexyltetradecylphosphonium tricyanomethanide
IN-0012-TG-1000	Trihexyltetradecylphosphonium hexafluorophosphate

Catalog	Name
sc-237318	Trihexyltetradecylphosphonium bromide
sc-237320	Trihexyltetradecylphosphonium decanoate
sc-237321	Trihexyltetradecylphosphonium dicyanamide
sc-237319	Trihexyltetradecylphosphonium chloride
sc-253758	Trihexyltetradecylphosphonium bis (trifluoromethylsulfonyl) amide
sc-301937	Trihexyltetradecylphosphonium bis (2,4,4-trimethylpentyl) phosphinate
29309654-500g	Hexadecyltrimethylammonium bromide (Cetyltrimethylammonium bromide)
CB0105	Cetyldimethylethyl ammonium bromide (Ethylhexadecyldimethylammonium bromide)
AR-I03852-01	Ipratropium Bromide Impurity 11 Bromide
AR-R11297-01	Rocuronium Bromide Impurity 7 Bromide