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1599-67-3

1599-67-3 structural image
Product Name: 1-DOCOSANOL
Formula: C22H44
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Liquid
Kovats Retention Index 2192 2195 2188 2191 2200 2189

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Health Hazard
GHS08
GHS Hazard Statements H304:Aspiration hazard
Precautionary Statement Codes P405:Store locked up.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 308.6 g/mol
XLogP3 12.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 0
Rotatable Bond Count 19
Exact Mass 308.344301404 g/mol
Monoisotopic Mass 308.344301404 g/mol
Topological Polar Surface Area 0 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 194
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 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

1-docosene is an alkene that is docosane with an unsaturation at position 1. Metabolite observed in cancer metabolism. It has a role as a human metabolite.

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