5-benzo[1,3]dioxol-5-yl-3-hexyl-cyclohex-2-en-1-one
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5-benzo[1,3]dioxol-5-yl-3-hexyl-cyclohex-2-en-1-one
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CAS No:
119-89-1
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Formula:
C19H24O3
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Chemical Name:
5-benzo[1,3]dioxol-5-yl-3-hexyl-cyclohex-2-en-1-one
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Synonyms:
Ent2,818;Brn0253168;Piperonylcyklonen;Piperonylcyklonen[czech];5-(1,3-Benzodioxol-5-yl)-3-hexyl-2-cyclohexen-1-one;5-benzo[1,3]dioxol-5-yl-3-hexyl-cyclohex-2-en-1-one;3-Hexyl-5-(3,4-methylenedioxyphenyl)-2-cyclohexen-1-one;2-Cyclohexen-1-one,3-hexyl-5-(3,4-(methylenedioxy)phenyl)-
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CAS No:
5-benzo[1,3]dioxol-5-yl-3-hexyl-cyclohex-2-en-1-one Basic Attributes
300.398
300.17300
DTXSID40107840
2932999014
Characteristics
35.53000
4.75860
1.099g/cm3
423.2ºC at 760mmHg
201.5ºC
1.541
2.28E-07mmHg at 25°C
Oral-Rat LD50: 5200 mg/kg
Safety Information
The warehouse is ventilated, low temperature and dry; stored and transported separately from food materials
Computed Properties
Molecular Weight:300.4
XLogP3:4.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:300.17254462
Monoisotopic Mass:300.17254462
Topological Polar Surface Area:35.5
Heavy Atom Count:22
Complexity:415
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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5-benzo[1,3]dioxol-5-yl-3-hexyl-cyclohex-2-en-1-one
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