Verdox
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Verdox
structure -
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CAS No:
88-41-5
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Formula:
C12H22O2
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Chemical Name:
Verdox
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Synonyms:
Cyclohexanol,2-(1,1-dimethylethyl)-,1-acetate;Cyclohexanol,2-(1,1-dimethylethyl)-,acetate;Cyclohexanol,2-tert-butyl-,acetate;2-tert-Butylcyclohexanol acetate;2-tert-Butylcyclohexyl acetate;o-tert-Butylcyclohexyl acetate;Verdox;2-(1,1-Dimethylethyl)cyclohexyl acetate;Agrumex HC;2-(1,1-Dimethylethyl)cyclohexyl ethanoate
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CAS No:
Description
O-TERT-BUTYLCYCLOHEXYL ACETATE exists in cis and trans forms. Pure 2-cistert-
butylcyclohexyl acetate is a crystalline solid, with a fruity citrus odor. The
commercial product is a colorless liquid and consists of a mixture of cis- and transisomers,
which contains 60–95% of the cis-ester. With an increasing percentage
of the trans-isomer, the odor becomes more woody and camphory.
The acetate is prepared by esterification of 2-tert-butylcyclohexanol, which is
obtained from 2-tert-butylphen
Liquid; OtherSolid
Characteristics
26.30000
3.96
Liquid; OtherSolid
0.9±0.1 g/cm3
34.95 °C
227 °C
>194 °F
1.451
Oral-rat LD50: 4600 mg/kg
Thermal decomposition emits spicy and irritating smoke
Safety Information
1
36/37/38
26-36
GV8962500
Xi
Low temperature dry and ventilated warehouse
P261-P305 + P351 + P338
H315-H319-H335
|H411 (98.98%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]|P273, P391, and P501|Aggregated GHS information provided by 196 companies from 3 notifications to the ECHA C&L Inventory.|H411 (98.29%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]|Aggregated GHS information provided by 2552 companies from 14 notifications to the ECHA C&L Inventory.|Warning|H336: May cause drowsiness or dizziness [Warning Specific target organ toxicity, single exposure; Narcotic effects]|P201, P202, P260, P261, P271, P273, P281, P304+P340, P308+P313, P312, P314, P391, P403+P233, P405, and P501
Verdox Use and Manufacturing
Odor agents
Air care products
1,000,000 - 10,000,000 lb
All other chemical product and preparation manufacturing|Cyclohexanol, 2-(1,1-dimethylethyl)-, 1-acetate, (1R,2R)-rel-: ACTIVE|Air Care|Cyclohexanol, 2-(1,1-dimethylethyl)-, 1-acetate: ACTIVE|Cyclohexanol, 2-(1,1-dimethylethyl)-, 1-acetate, (1R,2S)-rel-: ACTIVE
Cosmetics -> Solvent
Computed Properties
Molecular Weight:198.30
XLogP3:3.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:198.161979940
Monoisotopic Mass:198.161979940
Topological Polar Surface Area:26.3
Heavy Atom Count:14
Complexity:203
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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