Vetivert acetate
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Vetivert acetate
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CAS No:
117-98-6
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Formula:
C17H26O2
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Chemical Name:
Vetivert acetate
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Synonyms:
6-Azulenol,1,2,3,3a,4,5,6,8a-octahydro-4,8-dimethyl-2-(1-methylethylidene)-,6-acetate;6-Azulenol,1,2,3,3a,4,5,6,8a-octahydro-2-isopropylidene-4,8-dimethyl-,acetate;6-Azulenol,1,2,3,3a,4,5,6,8a-octahydro-4,8-dimethyl-2-(1-methylethylidene)-,acetate;Vetivert acetate;1,2,3,3a,4,5,6,8a-Octahydro-2-isopropylidene-4,8-dimethylazulen-6-yl acetate
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CAS No:
Characteristics
26.30000
4.26680
Colourless solid; Sweet woody aroma
0.99g/cm3
335.3ºC at 760mmHg
149.9ºC
1.501
Practically insoluble to insoluble in water
Flammable; decomposes by heating to release irritating smoke
Safety Information
Warehouse ventilated, low temperature and dry
P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, P391, P501
H317
|Danger|H304 (15.82%): May be fatal if swallowed and enters airways [Danger Aspiration hazard]|P261, P272, P273, P280, P301+P310, P302+P352, P321, P331, P333+P313, P363, P391, P405, and P501|Aggregated GHS information provided by 158 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Warning|H315 (21.11%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P272, P273, P280, P302+P352, P321, P332+P313, P333+P313, P362, P363, P391, and P501|Aggregated GHS information provided by 181 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, P391, and P501|Aggregated GHS information provided by 321 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Vetivert acetate Use and Manufacturing
6-Azulenol, 1,2,3,3a,4,5,6,8a-octahydro-4,8-dimethyl-2-(1-methylethylidene)-, 6-acetate: ACTIVE
Food additives -> Flavoring Agents|Flavouring Agent -> FLAVOURING_AGENT; -> JECFA Functional Classes|Flavoring Agents -> JECFA Flavorings Index
Flavoring Agents|Flavouring Agent -> FLAVOURING_AGENT;
Computed Properties
Molecular Weight:262.4
XLogP3:3.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:262.193280068
Monoisotopic Mass:262.193280068
Topological Polar Surface Area:26.3
Heavy Atom Count:19
Complexity:427
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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