β-apo-12′-Carotenal
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β-apo-12′-Carotenal
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CAS No:
1638-05-7
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Formula:
C25H34O
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Chemical Name:
β-apo-12′-Carotenal
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Synonyms:
2,4,6,8,10,12-Tridecahexaenal,2,7,11-trimethyl-13-(2,6,6-trimethyl-1-cyclohexen-1-yl)-,(2E,4E,6E,8E,10E,12E)-;12′-Apo-β-carotenal,all-trans-;12′-Apo-β,ψ-carotenal;12′-Apo-β-carotenal;(2E,4E,6E,8E,10E,12E)-2,7,11-Trimethyl-13-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8,10,12-tridecahexaenal;β-Apo-12′-carotenal;12′-Apo-β-caroten-12′-al;12-Apo-β-carotenal;β-apo-12′-Carotenal;all-trans-β-Apo-12′-carotenal;2,4,6,8,10,12-Tridecahexaenal,2,7,11-trimethyl-13-(2,6,6-trimethyl-1-cyclohexen-1-yl)-,(all-E)-;(all-E)-12′-Apo-β-caroten-12′-al;1101-22-0;16699-52-8;191741-82-9
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CAS No:
Description
12'-apo-beta-carotenal is an apo carotenoid C25 terpenoid compound arising from oxidative degradation of the beta,beta-carotene skeleton at the 12'-position. It is an enal and an apo carotenoid C25 terpenoid.
Safety Information
43-48/22-52/53
22-36/37-61
Xn
P260, P261, P272, P273, P280, P302+P352, P314, P321, P333+P313, P363, P501
H317
|Warning|H317: May cause an allergic skin reaction [Warning Sensitization, Skin]|P260, P261, P272, P273, P280, P302+P352, P314, P321, P333+P313, P363, and P501|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|Aggregated GHS information provided by 89 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:350.5
XLogP3:7.5
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:7
Exact Mass:350.260965704
Monoisotopic Mass:350.260965704
Topological Polar Surface Area:17.1
Heavy Atom Count:26
Complexity:700
Defined Bond Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes