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Cas Database |
| Name |
6-Chloro-2-hexanone |
EINECS | 233-546-5 |
| CAS No. | 10226-30-9 | Density | 0.989 g/cm3 |
| PSA | 17.07000 | LogP | 1.98450 |
| Solubility | Insoluble in water, soluble in chloroform (chloroform, carbon), n-heptane, ethanol, butanol, etc. | Melting Point |
N/A |
| Formula | C6H11 Cl O | Boiling Point | 207.6 °C at 760 mmHg |
| Molecular Weight | 134.606 | Flash Point | 91.6 °C |
| Transport Information | N/A | Appearance | Clear yellow to brown liquid |
| Safety | S26;S37/39 | Risk Codes | R36/37/38 |
| Molecular Structure |
|
Hazard Symbols |
|
| Synonyms |
1-Chlorohexan-5-one;4-Chlorobutyl methyl ketone; 5-Oxohexyl chloride; 6-Chloro-2-hexanone |
Article Data | 37 |
6-Chloro-2-hexanone Synthetic route
- 1462-03-9
1-methylcyclopentanol
- 10226-30-9
6-chloro-2-hexanone
| Conditions | Yield |
|---|---|
| With sodium hydrogencarbonate; iron(II) sulfate In tetrachloromethane Ambient temperature; in the dark; | 100% |
| With lead(IV) acetate; lithium chloride at 20 - 35℃; for 4h; Oxidation; oxidative decyclization; mechanical activation; | 51% |
| (i) aq. NaOCl, (ii) AgNO3, NaOH, aq. NH3; Multistep reaction; |
- 928-89-2
6-chlorohexene
- 10226-30-9
6-chloro-2-hexanone
| Conditions | Yield |
|---|---|
| With copper(l) iodide; oxygen; palladium dichloride In water; N,N-dimethyl-formamide for 48h; | 99% |
- 10297-06-0
1-chloro-5-hexyne
- 10226-30-9
6-chloro-2-hexanone
| Conditions | Yield |
|---|---|
| With (cyclohexylisocyanide)gold(I) chloride; water; potassium tetrakis(pentafluorophenyl)borate In methanol at 20℃; for 24h; Reagent/catalyst; | 99% |
| With methanol; [Co((dimethylglyoximate)BF2)2•2H2O] at 65℃; for 2.5h; Sealed tube; Neutral conditions; regioselective reaction; | 98% |
| With silver hexafluoroantimonate; SPGS-550-M; NOK; C35H47O3P*Au(1+)*Cl(1-); trifluoroacetic acid In water; toluene at 20℃; for 24h; Green chemistry; | 90% |
- 57987-84-5
2-methyl-5,6-dihydro-4H-pyran-3-carboxylic acid methyl ester
- 10226-30-9
6-chloro-2-hexanone
| Conditions | Yield |
|---|---|
| With hydrogenchloride at 50℃; for 3h; | 93% |
- 33694-90-5
1-methylcyclopentyl hypochlorite
- 10226-30-9
6-chloro-2-hexanone
| Conditions | Yield |
|---|---|
| In tetrachloromethane at 70℃; for 6h; Irradiation; | 90% |
| at 40℃; |
- 10226-30-9
6-chloro-2-hexanone
| Conditions | Yield |
|---|---|
| With hydrogenchloride In tetrahydrofuran for 0.5h; Heating; | 85% |
- 876384-79-1
N'-[5-Chloro-1-methyl-pent-(Z)-ylidene]-N,N-dimethyl-hydrazine
- 10226-30-9
6-chloro-2-hexanone
| Conditions | Yield |
|---|---|
| With water; copper dichloride In tetrahydrofuran; phosphoric acid | 84% |
| With boron trifluoride diethyl etherate In water; acetone | 64% |
- 77570-29-7
5-(1-Amino-5-chloro-pentylidene)-2,2-dimethyl-[1,3]dioxane-4,6-dione
- 10226-30-9
6-chloro-2-hexanone
| Conditions | Yield |
|---|---|
| With hydrogenchloride Heating; | 73% |
| Conditions | Yield |
|---|---|
| With pyridine; lead(IV) acetate; lithium chloride In benzene at 80℃; for 5h; | A 15% B 70% |
- 1779-49-3
Methyltriphenylphosphonium bromide
- 138344-21-5
4-Chloro-N,O-dimethylbutyric acid amide
- 10226-30-9
6-chloro-2-hexanone
| Conditions | Yield |
|---|---|
| Stage #1: Methyltriphenylphosphonium bromide With n-butyllithium In tetrahydrofuran; hexane at -15℃; Stage #2: 4-Chloro-N,O-dimethylbutyric acid amide In tetrahydrofuran; hexane at -78 - 20℃; Wittig reaction; Stage #3: With hydrogenchloride In tetrahydrofuran; diethyl ether; hexane at 20℃; | 68% |
6-Chloro-2-hexanone Chemical Properties
Empirical Formula: C6H11ClO
Molecular Weight: 134.6039 g/mol
EINECS: 233-546-5
Index of Refraction: 1.424
Density: 0.989 g/cm3
Flash Point: 91.6 °C
Enthalpy of Vaporization: 44.38 kJ/mol
Boiling Point: 207.6 °C at 760 mmHg
Vapour Pressure: 0.224 mmHg at 25 °C
Storage tempreture: Freezer
Appearance: Clear yellow to brown liquid
Structure of 6-Chloro-2-hexanone (CAS NO.10226-30-9):
IUPAC Name: 6-Chlorohexan-2-one
Product Category of 6-Chloro-2-hexanone (CAS NO.10226-30-9): Pharmaceutical Intermediates;Carbonyl Compounds;Ketones;Pentoxifylline
6-Chloro-2-hexanone Uses
6-Chloro-2-hexanone (CAS NO.10226-30-9) has been used as ntermediate for pentoxifylline .
6-Chloro-2-hexanone Toxicity Data With Reference
6-Chloro-2-hexanone (CAS NO.10226-30-9) hasn't been listed as a carcinogen by NTP, IARC, ACGIH, or CA Prop 65. And the toxicological properties have not been fully investigated.
6-Chloro-2-hexanone Safety Profile
Hazard Codes: 
Xi,
Xn
Risk Statements: 36/37/38-20/21/22
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 37/39-26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
S37/39:Wear suitable gloves and eye/face protection.
6-Chloro-2-hexanone Specification
6-Chloro-2-hexanone , its cas register number is 10226-30-9. It also can be called 2-Hexanone, 6-chloro- . It is hazardous, so the first aid measures and others should be known. Such as: When on the skin: first, should flush skin with plenty of water immediately for at least 15 minutes while removing contaminated clothing. Secondly, get medical aid. Or in the eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Then get medical aid soon. While, it's inhaled: Remove from exposure and move to fresh air immediately. Give artificial respiration while not breathing. When breathing is difficult, give oxygen. And as soon as to get medical aid. Then you have the ingesting of the product: Wash mouth out with water, and get medical aid immediately. Notes to physician: Treat supportively and symptomatically.
In addition, 6-Chloro-2-hexanone (CAS NO.10226-30-9) is not compatible with strong oxidizing agents, acids, acid chlorides, carbon dioxide, acid anhydrides, and you must not take it with incompatible materials. And also prevent it to broken down into hazardous decomposition products: carbon monoxide, carbon dioxide.
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