3,3-Dimethylcyclohexanone
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3,3-Dimethylcyclohexanone
structure -
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CAS No:
2979-19-3
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Formula:
C8H14O
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Chemical Name:
3,3-Dimethylcyclohexanone
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Synonyms:
Cyclohexanone,3,3-dimethyl-;3,3-Dimethylcyclohexanone;3,3-Dimethylcyclohexan-1-one
- Categories:
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CAS No:
Characteristics
17.1
1.8
0.906 g/cm3 @ Temp: 20 °C
173 °C
180 °C
50.1±10.7 °C
1.438
Insoluble in water.
Safety Information
III
UN 1993
3
R41
S26-S38
Xi:Irritant;
P280-P305 + P351 + P338
H226-H318
|Danger|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P305+P351+P338, P310, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 50 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:126.20
XLogP3:1.8
Hydrogen Bond Acceptor Count:1
Exact Mass:126.104465066
Monoisotopic Mass:126.104465066
Topological Polar Surface Area:17.1
Heavy Atom Count:9
Complexity:125
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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