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7735-42-4

7735-42-4 structural image
Product Name: 1,16-HEXADECANEDIOL
Formula: C16H34O2
Synonyms: Hexadecamethylene glycol
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 2130

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 258.44 g/mol
XLogP3 5.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 15
Exact Mass 258.255880323 g/mol
Monoisotopic Mass 258.255880323 g/mol
Topological Polar Surface Area 40.5 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 121
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

1,16-hexadecanediol is a diol that is hexadecane substituted by hydroxy groups at positions 1 and 16. It has a role as a plant metabolite. It is a long-chain primary fatty alcohol and a diol. It derives from a hydride of a hexadecane.