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7779-77-3

7779-77-3 structural image
Product Name: Isobutyl anthranilate
Formula: C11H15NO2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Isobutyl anthranilate is a brown liquid. Insoluble in water. (NTP, 1992)
Boiling Point 313 to 315 °F at 13.5 mmHg (NTP, 1992)
Solubility Insoluble (NTP, 1992)
Density 1.057-1.063
Refractive Index 1.534-1.540
Kovats Retention Index 1556

COMPUTED DESCRIPTORS

Molecular Weight 193.24 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 193.110278721 g/mol
Monoisotopic Mass 193.110278721 g/mol
Topological Polar Surface Area 52.3 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 192
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

Isobutyl anthranilate is a brown liquid. Insoluble in water. (NTP, 1992)