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| CAS No.: | 119-60-8 |
|---|---|
| Name: | DICYCLOHEXYL KETONE |
| Article Data: | 71 |
| Molecular Structure: | |
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|
|
| Formula: | C13H22 O |
| Molecular Weight: | 194.317 |
| Synonyms: | Cyclohexylketone (7CI,8CI); Bicyclohexyl ketone; Dicyclohexyl ketone;Dicyclohexylmethanone; NSC 49725; NSC 60007 |
| Density: | 0.97g/cm3 |
| Melting Point: | 57°C |
| Boiling Point: | 266.4°Cat760mmHg |
| Flash Point: | 123.4°C |
| Safety: | Poison by intravenous route. See also KETONES. A flammable liquid. When heated to decomposition it emits acrid and irritating fumes. |
| PSA: | 17.07000 |
| LogP: | 3.71610 |
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| Conditions | Yield |
|---|---|
| With 6C6H15P*4CF3O3S(1-)*2Ru(2+); acetone In 2,2,2-trifluoroethanol at 20℃; for 3h; Reagent/catalyst; | 99% |
| With tetra-O-acetyl riboflavin; lithium trifluoromethanesulfonate; 1,3-diisopropylthiourea In water; acetonitrile at 22℃; for 24h; Inert atmosphere; Sealed tube; Irradiation; | 90% |
| With isobutyl 4-[bis(acetoxy)iodo]phenylsulfonate; ruthenium trichloride In water; acetonitrile at 20℃; for 8h; | 89% |
- 2719-27-9
cyclohexanylcarbonyl chloride
- 446065-11-8
cyclohexyltrifluoro-λ4-borane potassium salt
- 119-60-8
dicyclohexyl ketone
| Conditions | Yield |
|---|---|
| With potassium fluoride; (1,2-dimethoxyethane)dichloronickel(II); Ir(dF(CF3)ppy)2(bpy)PF6; 4,4'-di-tert-butyl-2,2'-bipyridine In 1,2-dimethoxyethane at 24℃; for 24h; Inert atmosphere; Sealed tube; Irradiation; | 84% |
| Conditions | Yield |
|---|---|
| With sodium hydroxide; dihydrogen peroxide Ambient temperature; | 80% |
| Conditions | Yield |
|---|---|
| With tetraethyl ammonium permanganate at 20℃; for 0.666667h; | 80% |
| Conditions | Yield |
|---|---|
| With air; sodium nitrite In trifluoroacetic acid at 0 - 20℃; for 5h; | A 79% B n/a |
| Conditions | Yield |
|---|---|
| With [2,2]bipyridinyl; chloro-trimethyl-silane; nickel(II) bromide 2-methoxyethyl ether complex; zinc In tetrahydrofuran; N,N-dimethyl acetamide at 40℃; for 2h; Sealed tube; Inert atmosphere; | 76% |
- 95110-49-9
2'-cyclohexyl-2'-phenylsulfinylspiro
- 119-60-8
dicyclohexyl ketone
| Conditions | Yield |
|---|---|
| With sodium phenylselenide In ethanol for 16h; Heating; | 75% |
| With sodium phenylselenide In ethanol for 16h; Heating; | 75% |
| Conditions | Yield |
|---|---|
| In tetrahydrofuran at -80 - 20℃; Inert atmosphere; | 75% |
- 91-01-0
1,1-Diphenylmethanol
A
- 119-60-8
dicyclohexyl ketone
B
- 4453-82-1
Dicyclohexylmethanol
C
- 945-49-3
cyclohexylphenylmethanol
| Conditions | Yield |
|---|---|
| With hydrogen In water at 50℃; under 15001.5 Torr; for 6h; chemoselective reaction; | A 7 %Spectr. B 75% C 17% |
- 52034-92-1
dicyclohexylacetic acid
- 119-60-8
dicyclohexyl ketone
| Conditions | Yield |
|---|---|
| With (2,2'-dipyridyl)bis(5-methyl-2-(4-fluoro)phenylpyridine-N,C)iridium(III) hexafluorophosphate; oxygen; sodium carbonate; 1,1'-diethyl-4,4'-bipyridinium diperchlorate In dimethyl sulfoxide at 20℃; under 760.051 Torr; for 16h; Irradiation; | 65% |
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Chemistry
Empirical Formula: C13H22O
Molecular Weight: 194.3132 g/mol
EINECS: 204-336-0
Index of Refraction: 1.49
Density: 0.97 g/cm3
Flash Point: 123.4 °C
Enthalpy of Vaporization: 50.43 kJ/mol
Boiling Point: 266.4 °C at 760 mmHg
Vapour Pressure: 0.00868 mmHg at 25 °C
Structure of Dicyclohexyl ketone (CAS NO.119-60-8):
IUPAC Name of Dicyclohexyl ketone (CAS NO.119-60-8): Dicyclohexylmethanone
Canonical SMILES: C1CCC(CC1)C(=O)C2CCCCC2
InChI: InChI=1S/C13H22O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h11-12H,1-10H2
InChIKey: TWXWPPKDQOWNSX-UHFFFAOYSA-N
Product Categories of Dicyclohexyl ketone (CAS NO.119-60-8): Carbonyl Compounds;Ketones
Toxicity Data With Reference
| 1. | ivn-mus LD50:56 mg/kg | CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) NX#06751 . |
Consensus Reports
Reported in EPA TSCA Inventory.
Safety Profile
Poison by intravenous route. See also KETONES. A flammable liquid. When heated to decomposition it emits acrid and irritating fumes.
Safety Statements: 23-24/25
S23:Do not breathe vapour.
S24/25:Avoid contact with skin and eyes.
Standards and Recommendations
DOT Classification: 3; Label: Flammable Liquid
Specification
Dicyclohexyl ketone ,its cas register number is 119-60-8. It also can be called Methanone, dicyclohexyl- ; Dicyclohexylmethanone ; Ketone, dicyclohexyl ;and Cyclohexyl ketone .