Perillaldehyde
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Perillaldehyde
structure -
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CAS No:
2111-75-3
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Formula:
C10H14O
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Chemical Name:
Perillaldehyde
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Synonyms:
1-Cyclohexene-1-carboxaldehyde,4-(1-methylethenyl)-;Perillaldehyde;1-Cyclohexene-1-carboxaldehyde,4-isopropenyl-;4-(1-Methylethenyl)-1-cyclohexene-1-carboxaldehyde;Perilla aldehyde;4-Isopropenyl-1-cyclohexene-1-carboxaldehyde;Perillal;p-Mentha-1,8-dien-7-al;Perillyl aldehyde;4-Isopropenyl-1-cyclohexenecarboxaldehyde;4-(2-Propenyl)-1-cyclohexenecarboxaldehyde;(±)-Perillaldehyde;dl-Perillaldehyde;NSC 138642;1,8-p-Menthadien-7-al;4-(Prop-1-en-2-yl)cyclohex-1-ene-1-carboxaldehyde;Perillic aldehyde;6611-91-2;21090-66-4;1254961-45-9
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CAS No:
Description
p-Mentha-1,8-dien-7-al has a powerful fatty–spicy, oily, herbaceous odor.
Solid|Pale, yellowish oily liquid; powerful, fatty-spicy, oily-herbaceous odour
Perillyl aldehyde is an aldehyde that is cyclohex-1-ene-1-carbaldehyde substituted by a prop-1-en-2-yl group at position 4. It has a role as a mouse metabolite, a human metabolite and a volatile oil component. It is an olefinic compound and an aldehyde.
Characteristics
17.07000
2.68
Solid
0.9617 g/cm3 @ Temp: 18 °C
<25 °C
240 °C
204 °F
1.543
Insoluble in water; soluble in alcohols and oils
0.0434mmHg at 25°C
LD50 in mice (g/kg): 1.72 orally; in guinea pigs (g/kg): >5 dermally (Food Chem. Toxicol.)
Safety Information
3
36/37/38
26
GW2967200
Xi
P261, P264, P272, P280, P302+P352, P305+P351+P338, P321, P332+P313, P333+P313, P337+P313, P362, P363, P501
H315
|Warning|H315 (17.17%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P272, P280, P302+P352, P305+P351+P338, P321, P332+P313, P333+P313, P337+P313, P362, P363, and P501|Aggregated GHS information provided by 1683 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Perillaldehyde Use and Manufacturing
Perilla oil is obtained from the whole perilla herb by steam distillation, and then fractionated and refined.
GB 2760-1996 stipulates food flavors temporarily allowed to be used. Mainly used to prepare spices and peanut flavors.
1-Cyclohexene-1-carboxaldehyde, 4-(1-methylethenyl)-: ACTIVE
Food additives -> Flavoring Agents|Lipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C10 isoprenoids (monoterpenes) [PR0102]
Flavoring Agents|Flavouring Agent -> FLAVOURING_AGENT;
Computed Properties
Molecular Weight:150.22
XLogP3:2.6
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:150.104465066
Monoisotopic Mass:150.104465066
Topological Polar Surface Area:17.1
Heavy Atom Count:11
Complexity:201
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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