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102-19-2

102-19-2 structural image
Product Name: Isopentyl phenylacetate
Formula: C13H18O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colourless liquid; sweet musky animal odour with fruity balsamic undertone reminiscent of fresh cocoa beans
Boiling Point 268.00 °C. @ 760.00 mm Hg
Solubility Insoluble in water; soluble in oils
Density 0.975-0.981
LogP 3.870
Refractive Index 1.483-1.490
Kovats Retention Index 1477 1460 1468

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.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P332+P313:IF SKIN irritation occurs: Get medical advice/attention.

COMPUTED DESCRIPTORS

Molecular Weight 206.28 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 6
Exact Mass 206.130679813 g/mol
Monoisotopic Mass 206.130679813 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 181
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-Methylbutyl phenylacetate is a member of benzenes.

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