Cetyltrimethylammoniumhexafluorophosphate

Inquiry

Molecular Formula:

C19H42F6NP

Molecular Weight:

429.51

CAS Number:

101079-29-2

Catalog Number:

101079-29-2

Product Information

Molecular Formula:

C19H42F6NP

Molecular Weight:

429.51

Description

Cetyltrimethylammoniumhexafluorophosphate is a chemical compound extensively applied within the biomedical sector. It can be used to formulate effective drugs against a variety of diseases, including tumor abnormalities, microbial invasion, and neuronal dysfunction.

Synonyms

Cetyltrimethylammoniumhexafluorophosphate; n-Hexadecyltrimethylammonium hexafluorophosphate

IUPAC Name

hexadecyl(trimethyl)azaniumhexafluorophosphate

Canonical SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)C.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C19H42N.F6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;1-7(2,3,4,5)6/h5-19H2,1-4H3;/q+1;-1

InChI Key

XIHYIALOMDSESV-UHFFFAOYSA-N

Melting Point

185 °C

Purity

>98.0%(T)

Appearance

White to Almost white powder to crystal

Safety Information

Hazards

H315:
Causes skin irritation.
H319:
Causes serious eye irritation.

Precautionary Statement

P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

429.29590631 g/mol

Monoisotopic Mass

429.29590631 g/mol

Topological Polar Surface Area

0Å²

Heavy Atom Count

Formal Charge

Complexity

243

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
JP-2021155708-A	(Meta) Acrylic resin composition, vehicle composition for dispersing inorganic fine particles, inorganic fine particle dispersion slurry composition, and inorganic fine particle dispersion sheet	2020-03-25
WO-2021039959-A1	Binder for electricity storage devices improving dispersibility of conductive assistant	2019-08-29
WO-2021039960-A1	Binder for electricity storage devices	2019-08-29
CN-113711393-A	Binder for electricity storage device for improving dispersibility of conductive auxiliary agent	2019-08-29
US-2021265634-A1	Electrodes for energy storage devices	2019-07-05
WO-2021007183-A1	Electrodes for energy storage devices	2019-07-05
US-2022077455-A1	Electrodes for energy storage devices	2019-07-05
JP-2020132642-A	Cosmetic composition containing clay minerals	2019-02-19
JP-6698133-B2	Adhesive composition, adhesive sheet, and optical member	2018-10-10
CN-108577908-A	A kind of anus drag-hook and preparation method thereof	2018-05-15

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

Mass

Concentration

Volume

Molecular Weight *

Calculate

The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

Concentration _(start)

Volume _(start)

Concentration _(final)

Volume _(final)