3'-ALLYL-4'-HYDROXYACETOPHENONE
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3'-ALLYL-4'-HYDROXYACETOPHENONE
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CAS No:
1132-05-4
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Formula:
C11H12O2
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Chemical Name:
3'-ALLYL-4'-HYDROXYACETOPHENONE
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Synonyms:
3"-Allyl-4"-hydroxyacetophenone;Acetophenone, 3"-allyl-4"-hydroxy-;1-(3-Allyl-4-hydroxyphenyl)ethanone;1-(4-hydroxy-3-prop-2-enylphenyl)ethanone;Ethanone, 1-(4-hydroxy-3-(2-propenyl)phenyl)-;Ethanone, 1-[4-hydroxy-3-(2-propenyl)phenyl]-;Ethanone,1-[4-hydroxy-3-(2-propen-1-yl)phenyl]-;NSC89796;zlchem 1234;2-allyl-4-acetylphenol
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CAS No:
Characteristics
37.3
2.32330
1.075±0.06 g/cm3(Predicted)
115-119 °C(lit.)
200-201 °C(Press: 21 Torr)
138.2ºC
1.548
0.000121mmHg at 25°C
Safety Information
NONH for all modes of transport
3
41
26-39
Xi
Irritant
P280-P305 + P351 + P338
H318
|Danger|H318 (97.44%): Causes serious eye damage [Danger Serious eye damage/eye irritation]|P280, P305+P351+P338, and P310|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:176.21
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:176.083729621
Monoisotopic Mass:176.083729621
Topological Polar Surface Area:37.3
Heavy Atom Count:13
Complexity:198
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes