Dihydro-α-ionone
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Dihydro-α-ionone
structure -
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CAS No:
31499-72-6
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Formula:
C13H22O
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Chemical Name:
Dihydro-α-ionone
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Synonyms:
2-Butanone,4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-;4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-2-butanone;Dihydro-α-ionone;3,4-Dihydro-α-ionone;α-7,8-Dihydroionone;49749-39-5
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CAS No:
Characteristics
17.07000
3.73810
0.9254 g/cm3 @ Temp: 20 °C
119-121 °C @ Press: 10 Torr
98 °C
n20/D 1.477
1 ml in 1 ml 80% alcohol (in ethanol)
Safety Information
NONH for all modes of transport
2
36/37/38
26-36
EM0535000
Xi
P261-P305 + P351 + P338
H315-H319-H335
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 274 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Dihydro-α-ionone Use and Manufacturing
Partially hydrogenated by α-ionone.
Spices for food.
< 25,000 lb
2-Butanone, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-: ACTIVE
Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index
Flavoring Agents
Computed Properties
Molecular Weight:194.31
XLogP3:2.8
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:194.167065321
Monoisotopic Mass:194.167065321
Topological Polar Surface Area:17.1
Heavy Atom Count:14
Complexity:248
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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