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104-62-1

104-62-1 structural image
Product Name: PHENETHYL FORMATE
Formula: C9H10O2
Synonyms: Benzyl carbinyl formate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colourless liquid; colourless to slightly yellow liquid; powerful, green-herbaceous, rosy odour
Boiling Point 226.00 °C. @ 760.00 mm Hg
Solubility slightly
Density 1.056-1.065
Refractive Index 1.503-1.513
Kovats Retention Index 1156 1138.5 1141.9 1156 1149

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H317:Sensitisation, Skin
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 150.17 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 150.068079557 g/mol
Monoisotopic Mass 150.068079557 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 106
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

2-phenylethyl formate is a formate ester of 2-phenylethanol. It has a role as a metabolite. It is functionally related to a 2-phenylethanol.

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