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539-52-6

539-52-6 structural image
Product Name: perillen
Formula: C10H14O
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1086 1109 1099 1087 1086 1111 1091 1089 1111 1115 1115 1088 1089 1097 1119 1115 1097 1097 1110 1104

COMPUTED DESCRIPTORS

Molecular Weight 150.22 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 3
Exact Mass 150.104465066 g/mol
Monoisotopic Mass 150.104465066 g/mol
Topological Polar Surface Area 13.1 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 134
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

Perillene is a monoterpenoid that is furan in which the hydrogen at position 3 is replaced by a 4-methylpent-3-en-1-yl group. A defensive allomone of thrips that has a flowery, citrus-like flavour. It has a role as a semiochemical, a metabolite and a fragrance. It is a member of furans and a monoterpenoid.