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105-85-1

105-85-1 structural image
Product Name: CITRONELLYL FORMATE
Formula: C11H20O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description colourless liquid/strong, fruity, floral odour
Boiling Point 235.00 °C. @ 760.00 mm Hg
Solubility soluble in alcohol, most fixed oils; slightly soluble in propylene glycol; insoluble in glycerin, water
Density 0.890-0.903
LogP 3.800
Refractive Index 1.443-1.452
Kovats Retention Index 1262 1266 1261 1256.2 1258.9 1262 1261 1261 1261 1261 1261 1261 1262 1255.6 1252 1261 1260 1260.4 1261 1263 1261

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P271:Use only outdoors or in a well-ventilated area.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 184.27 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 7
Exact Mass 184.146329876 g/mol
Monoisotopic Mass 184.146329876 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 158
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Citronellyl formate is a carboxylic ester.

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