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472-97-9

472-97-9 structural image
Product Name: CARYOPHYLLENE ALCOHOL
Formula: C15H26O
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description White crystalline solid; Warm moss-like, spicy aroma
Solubility Practically insoluble or insoluble in water
Density 0.983-0.989 (20°)
Refractive Index 1.498-1.503

COMPUTED DESCRIPTORS

Molecular Weight 222.37 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 222.198365449 g/mol
Monoisotopic Mass 222.198365449 g/mol
Topological Polar Surface Area 20.2 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 309
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
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

Tricyclo(6.3.1.02,5)dodecan-1-ol, 4,4,8-trimethyl-, (1R,2S,5R,8S)- is a natural product found in Bazzania japonica, Corymbia citriodora, and Humulus lupulus with data available.

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