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2-Chlorocyclohexanone

2-Chlorocyclohexanone

CAS: 822-87-7

Molecular Formula: C6H9ClO

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2-Chlorocyclohexanone - Names and Identifiers

Name 2-Chlorocyclohexanone
Synonyms NSC 12439
Chlorocyclohexanone
2-CHLOROCYCLOHEXANONE
2-Chlorocyclohexonone
2-chloro-cyclohexanon
2-Chlorocyclohexanone
Cyclohexanone, 2-chloro-
alpha-Chlorocyclohexanone
(2S)-2-chlorocyclohexanone
(2R)-2-chlorocyclohexanone
2-Chlorocyclohexanone (stabilized with HQ + CaCO3)
CAS 822-87-7
EINECS 212-505-5
InChI InChI=1/C6H9ClO/c7-5-3-1-2-4-6(5)8/h5H,1-4H2/t5-/m0/s1

2-Chlorocyclohexanone - Physico-chemical Properties

Molecular FormulaC6H9ClO
Molar Mass132.59
Density1.161 g/mL at 25 °C (lit.)
Melting Point23 °C (lit.)
Boling Point82-83 °C/10 mmHg (lit.)
Flash Point180°F
Water SolubilityInsoluble in water.
Vapor Presure0.28mmHg at 25°C
AppearanceLiquid
Colorcolorless to very deep brown
BRN774100
Storage Condition2-8°C
Refractive Indexn20/D 1.484(lit.)
Physical and Chemical PropertiesMelting point 22-23 ℃, boiling point 90-91 ℃(1.86 Pa-2kPa),82-83 ℃(1.33kPa),79 ℃(0.93kPa), relative density 1.161(20/15 ℃), refractive index 1.4825. Flash point 82 °c.

2-Chlorocyclohexanone - Risk and Safety

Hazard SymbolsXi - Irritant
Irritant
Risk CodesR36/37/38 - Irritating to eyes, respiratory system and skin.
R43 - May cause sensitization by skin contact
Safety DescriptionS26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37 - Wear suitable protective clothing and gloves.
S37/39 - Wear suitable gloves and eye/face protection
S36 - Wear suitable protective clothing.
UN IDsUN 3335
WGK Germany3
RTECSGW1225000
FLUKA BRAND F CODES10-19
TSCAYes
HS Code29147000

2-Chlorocyclohexanone - Reference Information

NIST chemical information information provided by: webbook.nist.gov (external link)
EPA chemical substance information information provided by: ofmpeb.epa.gov (external link)
Use organic synthesis intermediates.
production method is obtained by chlorination of cyclohexanone. Chlorine gas was introduced into the cyclohexanone aqueous solution for chlorination. After completion of the reaction, the 2-chlorocyclohexanone liquid layer was separated, and the aqueous layer was extracted with ether. The extract was combined with the chlorocyclohexanone liquid layer, washed with water, then with a saturated solution of sodium chloride, and dried over anhydrous sodium sulfate. After filtration, diethyl ether was distilled off, and distillation under reduced pressure was performed to collect a 2-chlorocyclohexanone fraction.
category toxic substances
toxicity grade poisoning
Acute toxicity intraperitoneal-mouse LD50: 830 mg/kg
flammability hazard characteristics flammable; Toxic chloride fumes from thermal decomposition
storage and transportation characteristics low temperature ventilation and drying
fire extinguishing agent fog water, carbon dioxide, foam, dry powder
Last Update:2024-04-09 02:00:12
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2-Chlorocyclohexanone
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