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1989-52-2

1989-52-2 structural image
Product Name: Cholesteryl myristate
Formula: C41H72O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Clear, nearly colorless crystals; [Acros Organics MSDS]
Collision Cross Section 283.2 Ų [M+NH4]+ [CCS Type: TIMS, Method: calibrated with 4 ions from ESI LC/MS tuning mix (Agilent)]
Chemical Classes Biological Agents -> Cholesterol and Derivatives

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
Precautionary Statement Codes P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P330:Rinse mouth.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 597.0 g/mol
XLogP3 15.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 19
Exact Mass 596.55323154 g/mol
Monoisotopic Mass 596.55323154 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 43
Formal Charge 0
Complexity 873
Isotope Atom Count 0
Defined Atom Stereocenter Count 8
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Cholesteryl myristate is a cholesterol ester obtained by the formal condensation of the hydroxy group of cholesterol with the carboxy group of myristic acid. It has a role as a mouse metabolite.