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Palmityl behenate

CAT: 0804-HY-165865Size: 1 EachDry Ice: NoHazardous: No
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Description
Palmityl behenate (Behenic acid palmityl ester) is an ester product.
CAS Number
42233-11-4
Product Name Alternative
Behenic acid palmityl ester
UNSPSC
12352211
Target
Biochemical Assay Reagents
Type
Natural Products
Related Pathways
Others
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/palmityl-behenate.html
Smiles
CCCCCCCCCCCCCCCCCCCCCC(OCCCCCCCCCCCCCCCC)=O
Molecular Formula
C38H76O2
Molecular Weight
565.01
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Cetyl Behenate

The CIR Expert Panel concluded that the alkyl esters, listed subsequently, are safe in the present practices of use and concentration described in this safety assessment when formulated to be non-irritating.

CAS Number42233-11-4
PubChem CID162506
IUPAC Namehexadecyl docosanoate
Molecular FormulaC38H76O2
Molecular Weight565.0
XLogP18.4
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count36
Heavy Atom Count40
Formal Charge0
Complexity460
SMILES
CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCCCC
InChI
InChI=1S/C38H76O2/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-38(39)40-37-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h3-37H2,1-2H3
InChIKey
UEDYHQHDUXDFGA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cetyl Behenate
CAS: 42233-11-4
CID: 162506
Formula: C38H76O2
MW: 565.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight565.0
XLogP318.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count36
Exact Mass564.58453166
Monoisotopic Mass564.58453166
Topological Polar Surface Area26.3 Ų
Heavy Atom Count40
Formal Charge0
Complexity460
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-W554893-01Behenate (sodium)
HY-165894Myristoleyl behenate
HY-N2339-01Cholesteryl behenate
HY-W009082-01Methyl behenate
HY-165745Arachidyl behenate
HY-166221Linolenyl behenate
HY-166208Lauryl behenate
HY-166223Lignoceryl behenate
HY-165987Linoleyl behenate
HY-W127480Myristyl behenate

Alternative Products

CatalogName
MBS393434-01Palmityl Behenate
MBS6049125-01Palmityl Palmitate
MBS393451-01Palmityl Linoleate
MBS393417-01Palmityl Stearate
MBS393391-01Palmityl Laurate
TRC-P163700-1GPalmityl Myristate
MBS393460Palmityl Linolenate
MBS393458Palmityl Palmitoleate
sc-215669Palmityl acetate
MBS393426-01Palmityl Arachidate

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