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7787-20-4

7787-20-4 structural image
Product Name: (-)-FENCHONE
Formula: C10H16O
Synonyms: (−)-1,3,3-Trimethyl-2-norbornanone;(−)-Fenchone;(1R)-(−)-Fenchone;(1R)-1,3,3-Trimethylbicyclo[2.2.1]heptan-2-one;(1R)-1,3,3-Trimethylbicyclo[2.2.1]heptan-2-one
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Clear colorless to pale yellow liquid, Camphor herbal earthy woody aroma
Solubility Practically insoluble to insoluble
Density 0.941-0.946
Refractive Index 1.461-1.465

SAFETY INFORMATION

Signal word Warning
Pictogram(s)
GHS09
Environment
GHS09
GHS Hazard Statements H411:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P273:Avoid release to the environment.
P391:Collect spillage. Hazardous to the aquatic environment
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 152.23 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 152.120115130 g/mol
Monoisotopic Mass 152.120115130 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 217
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
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

(1R,4S)-fenchone is a fenchone that has (1R,4S)-stereochemistry. It is a constituent of the essential oils obtained from fennel. It has a role as a plant metabolite. It is an enantiomer of a (1S,4R)-fenchone.