Behenyl acrylate (C-22)

Inquiry

Molecular Formula:

C25H48O2

Molecular Weight:

380.65

CAS Number:

18299-85-9

Catalog Number:

18299-85-9

Product Information

Molecular Formula:

C25H48O2

Molecular Weight:

380.65

Description

Behenyl acrylate (C-22) is a vital constituent within the biomedical realm and is extensively employed in pharmaceutical fabrication and polymer coatings. Its remarkable intermolecular adherence and compatibility with diverse pharmaceutical compounds designate it as a highly desirable contender for drug conveyance mechanisms. Additionally, the utilization of Behenyl acrylate (C-22) extends to the domain of dermatology, wherein it ensues as an indispensable agent against cutaneous ailments, further serving as a safeguarding layer for medical instruments.

Synonyms

BEHENYL ACRYLATE; docosyl acrylate; C22-Alkyl acrylate; BEHENYL ACRYLATE (C-22); 2-Propenoic acid, docosyl ester; Docosylacrylat

IUPAC Name

docosyl prop-2-enoate

Canonical SMILES

CCCCCCCCCCCCCCCCCCCCCCOC(=O)C=C

InChI

InChI=1S/C25H48O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-25(26)4-2/h4H,2-3,5-24H2,1H3

InChI Key

KHAYCTOSKLIHEP-UHFFFAOYSA-N

Boiling Point

455.7ºC at 760mmHg

Melting Point

45.0 to 49.0 °C

Purity

95%

Density

0.865g/cm3

Appearance

White to Almost white powder to lump

Safety Information

Hazards

H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
H335:
May cause respiratory irritation.
H411:
Toxic to aquatic life with long-lasting effects.

Precautionary Statement

P261:
Avoid breathing dust, fumes, gas, mist, vapours, spray. [As modified by IV ATP].
P264:
Wash thoroughly after handling.
P273:
Avoid release to the environment.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P304+P340+P312:
IF INHALED:
Remove person to fresh air and keep comfortable for breathing.
Call a POISON CENTER or doctor/physician if you feel unwell.
P391:
Collect spillage.

Computed Properties

XLogP3

11.6

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

380.365430770 g/mol

Monoisotopic Mass

380.365430770 g/mol

Topological Polar Surface Area

26.3Å²

Heavy Atom Count

Formal Charge

Complexity

311

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

The molarity calculator equation

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

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The dilution calculator equation

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

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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Behenyl acrylate (C-22)

Product Information

Safety Information

Computed Properties

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