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87-29-6

87-29-6 structural image
Product Name: ANTHRANILIC ACID CINNAMYL ESTER
Formula: C16H15NO2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Cinnamyl anthranilate appears as brownish or reddish-yellow powder or light yellow solid with a fruity taste. (NTP, 1992)
Color/Form BROWNISH POWDER
Odor BALSAMIC, FRUITY ODOR SOMEWHAT REMINISCENT OF GRAPE
Boiling Point 630 °F at 760 mmHg (NTP, 1992)
Melting Point 142 to 143 °F (NTP, 1992)
Solubility less than 1 mg/mL at 63 °F (NTP, 1992)
Density 1.18 at 59.9 °F (NTP, 1992) - Denser than water; will sink
Stability/Shelf Life CHANGE ON EXPOSURE TO LIGHT, DUE TO PHOTOOXIDATION /AROMATIC AMINES & RELATED NITRO COMPD/
Chemical Classes Other Classes -> Esters, Other

COMPUTED DESCRIPTORS

Molecular Weight 253.29 g/mol
XLogP3 4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 253.110278721 g/mol
Monoisotopic Mass 253.110278721 g/mol
Topological Polar Surface Area 52.3 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 308
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

Cinnamyl anthranilate appears as brownish or reddish-yellow powder or light yellow solid with a fruity taste. (NTP, 1992)