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21835-01-8

21835-01-8 structural image
Product Name: 3-Ethyl-2-hydroxy-2-cyclopenten-1-one
Formula: C7H10O2
Synonyms: 3-Ethylcyclopentan-1,2-dione
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Boiling Point 78.00 to 80.00 °C. @ 4.00 mm Hg
Melting Point 38 - 40 °C
Solubility miscible with alcohol, glycerol, benzyl alcohol and water
Density 1.060-1.066
Refractive Index 1.470-1.480 (25°)
Kovats Retention Index 1100 1100

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H317:Sensitisation, Skin
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P272:Contaminated work clothing should not be allowed out of the workplace.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P333+P313:IF SKIN irritation or rash occurs: Get medical advice/attention.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 126.15 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 126.068079557 g/mol
Monoisotopic Mass 126.068079557 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 168
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

3-Ethyl-2-hydroxycyclopent-2-en-1-one is a cyclic ketone.