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68489-09-8

68489-09-8 structural image
Product Name: WS 12
Formula: C18H27NO2
Synonyms: (1R,2S,5R)-2-Isopropyl-N-(4-methoxyphenyl)-5-methylcyclohexanecarboxamide
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description White crystals; cool minty aroma
Solubility Insoluble in water; sparingly soluble in avocado oil

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Environment
GHS09
GHS Hazard Statements H410: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 289.4 g/mol
XLogP3 4.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 289.204179104 g/mol
Monoisotopic Mass 289.204179104 g/mol
Topological Polar Surface Area 38.3 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 334
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes