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1576-79-0

1576-79-0 structural image
Product Name: ACETIC ACID TRANS-2-HEPTEN-1-YL ESTER
Formula: C9H16O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colourless liquid; Fresh leaf aroma
Boiling Point 192.00 to 193.00 °C. @ 760.00 mm Hg
Solubility Practically insoluble to insoluble in water; soluble in non-polar solvents
Density 0.889-0.895
Refractive Index 1.428-1.434
Kovats Retention Index 1427

COMPUTED DESCRIPTORS

Molecular Weight 156.22 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 6
Exact Mass 156.115029749 g/mol
Monoisotopic Mass 156.115029749 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 128
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Hept-trans-2-en-1-yl acetate is a carboxylic ester.